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

*Links on SpectraBase are not permalinks.
Methyl 12-(phenylthio)dodecanoate
SpectraBase Compound ID 91UYCcw1pE9
InChI InChI=1S/C19H30O2S/c1-21-19(20)16-12-7-5-3-2-4-6-8-13-17-22-18-14-10-9-11-15-18/h9-11,14-15H,2-8,12-13,16-17H2,1H3
InChIKey IGLASVPHJHLMIN-UHFFFAOYSA-N
Mol Weight 322.51 g/mol
Molecular Formula C19H30O2S
Exact Mass 322.196651 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 CLKMhxIK56p
Name Methyl 12-(phenylthio)dodecanoate
CAS Registry Number 94473-28-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H30O2S
InChI InChI=1S/C19H30O2S/c1-21-19(20)16-12-7-5-3-2-4-6-8-13-17-22-18-14-10-9-11-15-18/h9-11,14-15H,2-8,12-13,16-17H2,1H3
InChIKey IGLASVPHJHLMIN-UHFFFAOYSA-N
Molecular Weight 322.507 g/mol
SMILES C(=O)(OC)CCCCCCCCCCCSc1ccccc1
SPLASH splash10-03dl-9403000000-16e04e8a6196249f8309
Source of Spectrum J-53-3821-24
Synonyms Methyl 12-(phenylsulfanyl)dodecanoate 12-(phenylthio)dodecanoic acid methyl ester Methyl 12-phenylsulfanyldodecanoate
Wiley ID 1321824