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

*Links on SpectraBase are not permalinks.
3-THAP 4-propylbenzoyl
SpectraBase Compound ID 9AC559h2yW2
InChI InChI=1S/C17H21NOS/c1-3-4-14-5-7-16(8-6-14)17(19)18-13(2)11-15-9-10-20-12-15/h5-10,12-13H,3-4,11H2,1-2H3,(H,18,19)
InChIKey AJNKIIHXKHCIGL-UHFFFAOYSA-N
Mol Weight 287.42 g/mol
Molecular Formula C17H21NOS
Exact Mass 287.134385 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 DnJ3oqvtZfk
Name 3-THAP 4-propylbenzoyl
Classification Aminoethylthiophene designer drug
Comments Spectrum verified by independent measurements in external laboratories
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 287.134385473 u
Formula C17H21NOS
InChI InChI=1S/C17H21NOS/c1-3-4-14-5-7-16(8-6-14)17(19)18-13(2)11-15-9-10-20-12-15/h5-10,12-13H,3-4,11H2,1-2H3,(H,18,19)
InChIKey AJNKIIHXKHCIGL-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 287.421 g/mol
Nominal Mass 287 u
Quality 996
Retention Index 2458
SMILES C(NC(CC=1C=CSC1)C)(C=1C=CC(=CC1)CCC)=O
SPLASH splash10-0002-1900000000-ac6c6b736a404f3cf48a
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-Propyl-N-[1-(thiophen-3-yl)propan-2-yl]-benzamide
Technique GC/MS
Wiley ID DD2024_023185