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

*Links on SpectraBase are not permalinks.
Benzeneacetaldehyde, .alpha.-[1-(phenylthio)ethylidene]-, (E)-
SpectraBase Compound ID 7RtgY6VPkYQ
InChI InChI=1S/C16H14OS/c1-13(18-15-10-6-3-7-11-15)16(12-17)14-8-4-2-5-9-14/h2-12H,1H3/b16-13-
InChIKey QVBYDZDMVXCRGL-SSZFMOIBSA-N
Mol Weight 254.35 g/mol
Molecular Formula C16H14OS
Exact Mass 254.076536 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 76R5Pk7jEOE
Name Benzeneacetaldehyde, .alpha.-[1-(phenylthio)ethylidene]-, (E)-
CAS Registry Number 119044-12-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14OS
InChI InChI=1S/C16H14OS/c1-13(18-15-10-6-3-7-11-15)16(12-17)14-8-4-2-5-9-14/h2-12H,1H3/b16-13-
InChIKey QVBYDZDMVXCRGL-SSZFMOIBSA-N
Molecular Weight 254.347 g/mol
SMILES c1(S\C(=C/(c2ccccc2)C=O)C)ccccc1
SPLASH splash10-02t9-0920000000-d08dad82809eadbad134
Source of Spectrum F-44-4466-0
Synonyms (2E)-2-phenyl-3-(phenylsulfanyl)-2-butenal (E)-2-Phenyl-3-phenylthiobut-2-enal
Wiley ID 1258020