SpectraBase Spectrum ID |
JGZ4zXGAnMO |
Name |
Benzo[c]thiophene |
CAS Registry Number |
270-82-6 |
Classification |
Chemical |
Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
Exact Mass |
134.019021367 u |
Formula |
C8H6S |
InChI |
InChI=1S/C8H6S/c1-2-4-8-6-9-5-7(8)3-1/h1-6H |
InChIKey |
LYTMVABTDYMBQK-UHFFFAOYSA-N |
Ionization Type |
Electron Ionization (EI) |
Molecular Weight |
134.196 g/mol |
Nominal Mass |
134 u |
Quality |
915 |
Retention Index |
974 |
SMILES |
C1=2C(=CSC2)C=CC=C1 |
SPLASH |
splash10-001i-6900000000-dcc7ba55c4c18d22d196 |
Source of Spectrum |
DigiLab GmbH (C) 2024 |
Synonyms |
2-benzothiophene |
Technique |
GC/MS |
Wiley ID |
DD2024_032265 |