+   Top 30 Substance classes

designer-drug cannabinoid 151 
designer-drug cathinone 107 
02 tranquilliser 64 
designer-drug opioid 55 
11 analgesic 51 
designer-drug phenethylamine 50 
10 antihistamine 44 
01 11 narcotic analgesic 43 
13 sympathomimetic 43 
37 anticholinergic 38 
17 diuretic 31 
08 antihypertensive 29 
03 antidepressant 27 
09 local anaesthetic 23 
18 antibiotic 23 
05 barbiturate 22 
16 muscle relaxant 22 
28 hallucinogen 21 
20 corticosteroid 19 
designer-drug benzodiazepine 19 
34 pesticide 18 
designer-drug arylalkylamine 18 
04 anticonvulsant 15 
designer-drug piperidine 15 
32 solvent 14 
06 hypnotic 13 
23 antidiabetic 13 
36 herbicide 13 
60 vasodilator 13 
41 antineoplastic 12 

Total: 1729 |  1 - 10 
1,4-DIBENZYLPIPERAZINE
DibenzylpiperazineN,N'-Dibenzylpiperazine1,4-Dibenzyl-piperazine1,4-дибензилпиперазин

            

1,4-dibenzylpiperazine

C18H22N2

13

266.39 (266.18)

designer-drug piperazine

1034-11-3

y-white powder (HCl);

287.0   N/A

H2O-S; CH3OH-S;

-;

00-TA

0

2292   9.09   8.08

91,120,175,65,92,132,134,146,119,266

m/z 9191m/z 120120m/z 175175m/z 6565m/z 9292m/z 132132m/z 134134m/z 146146m/z 119119m/z 266266MW=266.18

0.00-HA

-    

761,709,619,1457,952,1430,1336,1041,1214,1083

761 cm-1761709 cm-1709619 cm-16191457 cm-11457952 cm-19521430 cm-114301336 cm-113361041 cm-110411214 cm-112141083 cm-11083

New Psychoactive Substance (NPS). A controlled substance in China. Legal status: n/a. GC RI 2292 (estimated with error: 83). Caymanchem CAS RN 2298-55-7 (2HCl); A crystalline solid. GC/MS RT=9.09min; 30mx0.32mm, 0.5u Rtx-5MS, 50C-30C/min-300C.

Dibenzylpiperazine (DBZP) is a piperazine derivative often found as an impurity in the recreational stimulant drug benzylpiperazine (BZP). Presence of DBZP is a marker for low quality or badly made BZP. It can be made as a reaction byproduct during BZP synthesis, either because the reaction has been run at too high a temperature, or because an excess of benzyl chloride has been used.

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YPUGLZQRXQQCSX-UHFFFAOYSA-N
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1-(4-METHYLPHENYL)-2-(PIPERIDIN-1-YL)PROPAN-1-ONE
4'-Methyl-2-piperidinopropiophenone1-(4-метилфенил)-2-(пиперидин-1-ил)пропан-1-он

            

1-(4-methylphenyl)-2-(piperidin-1-yl)propan-1-one

C15H21NO

9

231.34 (231.16)

designer-drug cathinone

25872-67-7

y-off-white powder;

N/A   N/A

H2O-S; CH3OH-S; CH2Cl2-B;

-;

00-TA

0

0   5.97

112,113,41,56,91,55,119,65,44,69

m/z 112112m/z 113113m/z 4141m/z 5656m/z 9191m/z 5555m/z 119119m/z 6565m/z 4444m/z 6969MW=231.16

0.00-HA

-    

1683,1608,921,772,1235,1181,1117,1206,1452,974

1683 cm-116831608 cm-11608921 cm-1921772 cm-17721235 cm-112351181 cm-111811117 cm-111171206 cm-112061452 cm-11452974 cm-1974

New Psychoactive Substance (NPS). Legal status: n/a. Caymanchem n/a.

Response: Salt form: Gallic acid (3,4,5-trihydroxybenzoic acid). IR: FTIR-ATR - direct measurement - sample with a substantial amount of the gallic acid (cm-1): 1339,1184,1034,735,791,969,556,1262,651,1525.

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DHZOVKWINAURCF-UHFFFAOYSA-N
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10,11-DIHYDRO-10,11-DIHYDROXYCARBAMAZEPINE
trans-10,11-DihydroxycarbamazepineCarbamazepine-10,11-diolCBZ-diol

            

(5R,6R)-5,6-dihydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide

C15H14N2O3

17

270.29 (270.10)

46 metabolite of carbamazepine

58955-93-4

-;

220.0   N/A

H2O-N; (C2H5)2O-N; C2H5OH-S; (CH3)2CO-S;

-;

-

0

0

180,77,44,181,179,51,209,167

m/z 180180m/z 7777m/z 4444m/z 181181m/z 179179m/z 5151m/z 209209m/z 167167MW=270.10

-

-   -  -

-

-

10,11-trans-dihydroxy-10,11-dihydrocarbamazepine is a dibenzoazepine that is 10,11-dihydro-5H-dibenzo[b,f]azepine-5-carboxamide substituted by hydroxy groups at positions 10 and 11. It is a metabolite of the drug carbamazepine. 10, 11-Dihydroxycarbamazepine, also called carbamazepine diol, is a metabolite of both carbamazepine and oxcarbazepine. Carbamazepine (CBZ) is an anticonvulsant and mood-stabilizing drug used primarily in the treatment of epilepsy and bipolar disorder, as well as trigeminal neuralgia. Oxcarbazepine is an anticonvulsant and mood-stabilizing drug, used primarily in the treatment of epilepsy. It is also used to treat anxiety and mood disorders, and benign motor tics.

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PRGQOPPDPVELEG-ZIAGYGMSSA-N
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10,11-DIHYDRO-10-HYDROXYCARBAMAZEPINE
10-HydroxycarbazepineLicarbazepineCarbamazepine-10-olCBZ-ol

            

5-hydroxy-5,6-dihydrobenzo[b][1]benzazepine-11-carboxamide

C15H14N2O2

16

254.29 (254.11)

46 metabolite of oxcarbazepine

29331-92-8

-;

186.0   N/A

H2O-B; C2H5OH-S;

-;

-

0

0   2528

193,180,194,-,-,-,-,-

m/z 193193m/z 180180m/z 194194m/z --m/z --m/z --m/z --m/z --MW=254.11

-

-   -  -

-

-

Licarbazepine is a voltage-gated sodium channel blocker with anticonvulsant and mood-stabilizing effects that is related to oxcarbazepine. It is an active metabolite of oxcarbazepine. 10-Hydroxycarbazepine is an active metabolite of oxcarbazepine. Oxcarbazepine is a anticholinergic anticonvulsant and mood stabilizing drug, used primarily in the treatment of epilepsy. It is also used to treat anxiety and mood disorders, and benign motor tics. Oxcarbazepine is marketed as Trileptal by Novartis and available in some countries as a generic drug.

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BMPDWHIDQYTSHX-UHFFFAOYSA-N
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10,11-EPOXYCARBAMAZEPINE
Carbamazepine-10,11-epoxideCarbamazepine epoxideCarbamazepine 10,11-epoxide10,11-Эпоксикарбамазепин

            

1a,10b-dihydro-6H-dibenzo[b,f]oxireno[d]azepine-6-carboxamide

C15H12N2O2

18

252.27 (252.09)

46 metabolite of carbamazepine

36507-30-9

y-white/off-white powder;

204.0   N/A

H2O-N; (C2H5)2O-N; C2H5OH-S; (CH3)2CO-S;

-;

-

0

2030

180,179,178,152,44,181,223,29

m/z 180180m/z 179179m/z 178178m/z 152152m/z 4444m/z 181181m/z 223223m/z 2929MW=252.09

-

-   -  -

-

CAS, appearance: SigmaAldrich.

An epoxide and metabolite of carbamazepine. Carbamazepine (CBZ) is an anticonvulsant and mood-stabilizing drug used primarily in the treatment of epilepsy and bipolar disorder, as well as trigeminal neuralgia. sigma-aldrich

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ZRWWEEVEIOGMMT-UHFFFAOYSA-N
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10-HYDROXYNORTRIPTYLINE
Hydroxynortriptyline10-Hydroxy-(Z)-nortriptyline10-гидроксинортриптилин

            

(5Z)-10,11-Dihydro-5-[3-(methylamino)propylidene]-5H-dibenzo[a,d]cyclohepten-10-ol

C19H21NO

14

279.38 (279.16)

46 metabolite of nortriptyline

1156-99-6

-;

N/A   N/A

-;

-;

-

0

2325   2385

44,45,26,218,215,203,202,42

m/z 4444m/z 4545m/z 2626m/z 218218m/z 215215m/z 203203m/z 202202m/z 4242MW=279.16

1.8 -HA

-   -  -

-

NORTRIPTYLINE is metabolite of AMITRIPTYLINE.

In one study of long-term efficacy, nortriptyline showed a higher relapse rate in comparison with phenelzine in individuals being treated for depression, possibly due to the metabolite 10-hydroxynortriptyline being produced. See also NIST Hydroxynortriptyline (an isomer).

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VAGXZGJKNUNLHK-WJDWOHSUSA-N
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11-HYDROXYTETRAHYDROCANNABINOL
11-Hydroxy-δ(9)-THC11-Hydroxy-Δ9-tetrahydrocannabinol11-OH-THC1-гидрокси-тетрагидроканнабинол11-Гидрокси-Δ9-ТГК

            

9-(Hydroxymethyl)-6,6-dimethyl-3-pentyl-6a,7,8,10a-tetrahydro-6H-benzo[c]chromen-1-ol

C21H30O3

11

330.47 (330.22)

46 metabolite of THC

36557-05-8

-;

N/A   N/A

;

-;

-

0

0   2903

299,300,330,-,-,-,-,-

m/z 299299m/z 300300m/z 330330m/z --m/z --m/z --m/z --m/z --MW=330.22

-

-    

-

- MS predicted by CFM(EI): available.

11-Hydroxy-Δ9-tetrahydrocannabinol (11-OH-THC) is the main active metabolite of Tetrahydrocannabinol (THC) which is formed in the body after cannabis is consumed. The conversion from THC to 11-OH-THC is relatively high when cannabis is consumed in the form of cannabis edibles and, compared to oral consumption, lower when it is smoked or vaped.

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YCBKSSAWEUDACY-IAGOWNOFSA-N
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2,3-DIMETHYLMETHCATHINONE
2,3-DMMC2,3-диметилметкатинон

            

1-(2,3-dimethylphenyl)-2-(methylamino)propan-1-one

C12H17NO

8

191.27 (191.13)

designer-drug cathinone

1448258-72-7

y-white-pale (HCl);

202.0   N/A

H2O-S; CHCl3-S;

-;

00-TA

0

0   6.48   3.94

58,77,56,105,79,103,133,174,146,190

m/z 5858m/z 7777m/z 5656m/z 105105m/z 7979m/z 103103m/z 133133m/z 174174m/z 146146m/z 190190MW=191.13

0.00-HA

252,292    

754,1700,1078,800,970,1290,1463,1428,902,829

754 cm-17541700 cm-117001078 cm-11078800 cm-1800970 cm-19701290 cm-112901463 cm-114631428 cm-11428902 cm-1902829 cm-1829

New Psychoactive Substance (NPS). Legal status: n/a. Caymanchem CAS RN 1797981-99-7 (HCl); A crystalline solid; UV max 252,292nm. GC/MS RT=6.48min; 30mx0.32mm, 0.5u Rtx-MS, 50C-30C/min-300C.

Caymanchem: 2,3-Dimethylmethcathinone (hydrochloride) is a potential designer drug with combined features of amphetamines, cathinones, and phenethylamines. It is structurally related to 4-methylmethcathinone, a psychoactive compound that has been identified in products sold as bath salts and plant food.

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APVRHNHXZXFDLN-UHFFFAOYSA-N
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2,5-DIMETHOXY-4-METHYLPHENETHYLAMINE
2C-D2C-M2,5-диметокси-4-метилфенетиламин

            

1-(2,5-Dimethoxy-4-methylphenyl)-2-aminoethane

C11H17NO2

8

195.26 (195.13)

designer-drug phenethylamine

24333-19-5

y-white powder (HCl);

211.0   N/A

-;

-;

00-TA

0

1627   6.94   4.46

166,151,135,91,165,195,77,79,167,105

m/z 166166m/z 151151m/z 135135m/z 9191m/z 165165m/z 195195m/z 7777m/z 7979m/z 167167m/z 105105MW=195.13

0.00-HA

227,292    

1207,1042,1510,845,1401,1180,1462,640,802,1114

1207 cm-112071042 cm-110421510 cm-11510845 cm-18451401 cm-114011180 cm-111801462 cm-11462640 cm-1640802 cm-18021114 cm-11114

New Psychoactive Substance (NPS). CAS RN HCl: 25505-65-1. Legal status: CA:Schedule III; US:Schedule I; DE:Anlage I. DK:Schedule B. A controlled substance in China. Caymanchem: A crystalline solid (HCl); UV max 227,292nm. GC/MS RT=6.94min; 30mx0.32mm, 0.5u Rtx-5MS, 50C-30C/min-300C. GC RI 1627 (estimated with error: 89).

2C-D is a psychedelic drug of the 2C family that is sometimes used as an entheogen. The full name of the chemical is 2,5-dimethoxy-4-methylphenethylamine. Caymanchem: A series of 2,5-dimethoxy phenethylamines, collectively referred to as 2Cs, have psychoactive effects. The most effective 2C compounds are substituted at the 4 position of the aromatic ring. Many are scheduled as illegal substances.3,4 2C-D is described formally as 2,5-dimethoxy-4-methylphenethylamine.

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UNQQFDCVEMVQHM-UHFFFAOYSA-N
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2,5-DIMETHOXY-N-METHYLPHENETHYLAMINE
N-Me-2C-H2-(2,5-dimethoxyphenyl)-N-methylethanamineN-Me-2,5-DMPEA2,5-диметокси-N-метилфенетиламин

            

2,5-Dimethoxy-N-methylphenethylamine

C11H17NO2

8

195.26 (195.13)

designer-drug phenethylamine

3489-95-0

y-white powder (HCl);

N/A   N/A

H2O-S; CH3OH-S;

-;

00-TA

0

0   4.25

44,152,137,77,91,78,121,42,195,162

m/z 4444m/z 152152m/z 137137m/z 7777m/z 9191m/z 7878m/z 121121m/z 4242m/z 195195m/z 162162MW=195.13

0.00-HA

-    

1223,1043,1504,702,1465,801,1189,850,1419,956

1223 cm-112231043 cm-110431504 cm-11504702 cm-17021465 cm-11465801 cm-18011189 cm-11189850 cm-18501419 cm-11419956 cm-1956

New Psychoactive Substance (NPS). CAS RN HCl: 13063-01-9. Legal status: n/a. Caymanchem n/a.

Chiron: N-Me-2C-H hydrochloride; CAS RN 13063-01-9; Specification: 100µg base/mL in methanol.

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PIGIFXLLTQEIPK-UHFFFAOYSA-N
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