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

*Links on SpectraBase are not permalinks.
2-[4'-(Methoxycarbonyl)-1'-methylthiobutan-1'-yl]-5-(1"-methylthiononadeca-1"-yl)-tetrahydrothiophene
SpectraBase Compound ID mhZ2kbl6lE
InChI InChI=1S/C31H60O2S3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-27(34-3)29-25-26-30(36-29)28(35-4)23-21-24-31(32)33-2/h27-30H,5-26H2,1-4H3
InChIKey MMIPEQZEFYBMBT-UHFFFAOYSA-N
Mol Weight 561.0 g/mol
Molecular Formula C31H60O2S3
Exact Mass 560.375545 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 KfLqt2WreFk
Name 2-[4'-(Methoxycarbonyl)-1'-methylthiobutan-1'-yl]-5-(1"-methylthiononadeca-1"-yl)-tetrahydrothiophene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C31H60O2S3
InChI InChI=1S/C31H60O2S3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-27(34-3)29-25-26-30(36-29)28(35-4)23-21-24-31(32)33-2/h27-30H,5-26H2,1-4H3
InChIKey MMIPEQZEFYBMBT-UHFFFAOYSA-N
Molecular Weight 560.999 g/mol
SMILES C1(SC(CC1)C(SC)CCCC(=O)OC)C(SC)CCCCCCCCCCCCCCCCCC
SPLASH splash10-00l2-3902000000-84ff8d3e19a95ffce4be
Source of Spectrum X2-56-745-0
Synonyms Methyl 5-(methylsulfanyl)-5-{5-[1-(methylsulfanyl)nonadecyl]tetrahydro-2-thienyl}pentanoate
Wiley ID 1604905