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

*Links on SpectraBase are not permalinks.
4-Methyl-2-(3-phenylpropylthio)-4-pentenoic acid ethyl ester
SpectraBase Compound ID JIR0uJQksOq
InChI InChI=1S/C17H24O2S/c1-4-19-17(18)16(13-14(2)3)20-12-8-11-15-9-6-5-7-10-15/h5-7,9-10,16H,2,4,8,11-13H2,1,3H3
InChIKey PQNBAUYXZQIFLP-UHFFFAOYSA-N
Mol Weight 292.44 g/mol
Molecular Formula C17H24O2S
Exact Mass 292.149701 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 C9BYT3POkiK
Name 4-Methyl-2-(3-phenylpropylthio)-4-pentenoic acid ethyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H24O2S
InChI InChI=1S/C17H24O2S/c1-4-19-17(18)16(13-14(2)3)20-12-8-11-15-9-6-5-7-10-15/h5-7,9-10,16H,2,4,8,11-13H2,1,3H3
InChIKey PQNBAUYXZQIFLP-UHFFFAOYSA-N
Molecular Weight 292.437 g/mol
SMILES C(C(CC(=C)C)SCCCc1ccccc1)(=O)OCC
SPLASH splash10-014l-2900000000-78ca71ddca9bdf6021f4
Source of Spectrum KC-0-511-20
Synonyms 4-Methyl-2-(3-phenylpropylthio)pent-4-enoic acid ethyl ester Ethyl 4-methyl-2-(3-phenylpropylsulfanyl)pent-4-enoate
Wiley ID 780741