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Etizolam isomer
SpectraBase Compound ID ACNnCS6GDxE
InChI InChI=1S/C17H15ClN4S/c1-3-11-8-13-16(12-6-4-5-7-14(12)18)19-9-15-21-20-10(2)22(15)17(13)23-11/h4-10H,3H2,1-2H3
InChIKey DSQDSEGWFUULHK-UHFFFAOYSA-N
Mol Weight 342.85 g/mol
Molecular Formula C17H15ClN4S
Exact Mass 342.070595 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DnzZsNriVpQ
Name Etizolam isomer
Classification Pharmaceutical drug, hypnotic sedative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 342.070595373 u
Formula C17H15ClN4S
InChI InChI=1S/C17H15ClN4S/c1-3-11-8-13-16(12-6-4-5-7-14(12)18)19-9-15-21-20-10(2)22(15)17(13)23-11/h4-10H,3H2,1-2H3
InChIKey DSQDSEGWFUULHK-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 342.848 g/mol
Nominal Mass 342 u
Quality 986
Retention Index 2769
SMILES C1=2N3C(=CN=C(C2C=C(S1)CC)C1=C(C=CC=C1)Cl)N=NC3C
SPLASH splash10-052f-2697000000-fe29b0466405b2df6a39
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-(2-chlorophenyl)-2-ethyl-9-methyl-9H-thieno[3,2-f][1,2,4]triazolo[4,3-a][1,4]diazepine
Technique GC/MS
Wiley ID DD2024_027907