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

*Links on SpectraBase are not permalinks.
(2E,4E)-4,5-dimethyl-6-(4-methylphenylthio)hexa-2,4-dienoate
SpectraBase Compound ID JMfxaFSjFfM
InChI InChI=1S/C16H20O2S/c1-12-5-8-15(9-6-12)19-11-14(3)13(2)7-10-16(17)18-4/h5-10H,11H2,1-4H3/b10-7+,14-13+
InChIKey AYGLYFFRUOJDGU-CDITWBNYSA-N
Mol Weight 276.39 g/mol
Molecular Formula C16H20O2S
Exact Mass 276.118401 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 6fbZqDVjdsK
Name (2E,4E)-4,5-dimethyl-6-(4-methylphenylthio)hexa-2,4-dienoate
Alternate Name(s) (2E,4E) and (2E,4Z)-Methyl 4,5-dimethyl-6-(4-methylphenylthio)hexa-2,4-dienoate (2E,4E)-Methyl 4,5-dimethyl-6-(4-methylphenylthio)hexa-2,4-dienoate methyl (2E,4E)-4,5-dimethyl-6-[(4-methylphenyl)sulfanyl]-2,4-hexadienoate
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20O2S
InChI InChI=1S/C16H20O2S/c1-12-5-8-15(9-6-12)19-11-14(3)13(2)7-10-16(17)18-4/h5-10H,11H2,1-4H3/b10-7+,14-13+
InChIKey AYGLYFFRUOJDGU-CDITWBNYSA-N
Molecular Weight 276.394 g/mol
SMILES C(\C(=C\(\C=C\C(=O)OC)C)C)Sc1ccc(cc1)C
SPLASH splash10-0006-9020000000-5fc40ec2f03443dfb7a4
Source of Spectrum KC-0-840-4
Wiley ID 787783