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

*Links on SpectraBase are not permalinks.
(E)-3-phenyl-2-propenethioic acid O-ethyl ester
SpectraBase Compound ID CJ7l8cFMxwS
InChI InChI=1S/C11H12OS/c1-2-12-11(13)9-8-10-6-4-3-5-7-10/h3-9H,2H2,1H3/b9-8+
InChIKey BBGYVZJRHVBAEI-CMDGGOBGSA-N
Mol Weight 192.28 g/mol
Molecular Formula C11H12OS
Exact Mass 192.060886 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 14WWLlUuqkT
Name (E)-3-phenyl-2-propenethioic acid O-ethyl ester
Alternate Name(s) (E)-3-phenylprop-2-enethioic acid O-ethyl ester Ethyl thionocinnamate O-ethyl (E)-3-phenylprop-2-enethioate
CAS Registry Number 80095-81-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H12OS
InChI InChI=1S/C11H12OS/c1-2-12-11(13)9-8-10-6-4-3-5-7-10/h3-9H,2H2,1H3/b9-8+
InChIKey BBGYVZJRHVBAEI-CMDGGOBGSA-N
Molecular Weight 192.276 g/mol
SMILES C(\C=C\c1ccccc1)(=S)OCC
SPLASH splash10-014l-0900000000-2e7a91bbe4ecb7a80b95
Source of Spectrum SB-35-244-0
Wiley ID 1188277