For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
3-THAP-A (2CH2=O,-2H2O+2H)
SpectraBase Compound ID BtJR8HEGnzQ
InChI InChI=1S/C9H13NS/c1-7-5-8-3-4-11-9(8)6-10(7)2/h3-4,7H,5-6H2,1-2H3
InChIKey AADGNZUWSQDYCC-UHFFFAOYSA-N
Mol Weight 167.27 g/mol
Molecular Formula C9H13NS
Exact Mass 167.076871 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 2l54lAQCopU
Name 3-THAP-A (2CH2=O,-2H2O+2H)
Classification Designer drug artifact
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 167.076870597 u
Formula C9H13NS
InChI InChI=1S/C9H13NS/c1-7-5-8-3-4-11-9(8)6-10(7)2/h3-4,7H,5-6H2,1-2H3
InChIKey AADGNZUWSQDYCC-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 167.270 g/mol
Nominal Mass 167 u
Quality 978
Retention Index 1270
SMILES C12=C(CN(C(C2)C)C)SC=C1
SPLASH splash10-03di-3900000000-bf7b811b0799b96acf3a
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 5,6-Dimethyl-4,5,6,7-tetrahydrothieno[2,3-c]pyridine
Technique GC/MS
Wiley ID DD2024_023383