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

*Links on SpectraBase are not permalinks.
2-HYDROXY-2-(METHYLTHIO)VALERIC ACID, METHYL ESTER, ACETATE
SpectraBase Compound ID 8TqdnDuXg73
InChI InChI=1S/C9H16O4S/c1-5-6-9(14-4,8(11)12-3)13-7(2)10/h5-6H2,1-4H3
InChIKey HXWZBBVZZQVGHI-UHFFFAOYSA-N
Mol Weight 220.28 g/mol
Molecular Formula C9H16O4S
Exact Mass 220.07693 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID hoqUsOuY4u
Name 2-HYDROXY-2-(METHYLTHIO)VALERIC ACID, METHYL ESTER, ACETATE
Source of Sample B. M. Trost, G. S. Massiot J. Amer. Chem. Soc. 99, 4405(1977)
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H16O4S
InChI InChI=1S/C9H16O4S/c1-5-6-9(14-4,8(11)12-3)13-7(2)10/h5-6H2,1-4H3
InChIKey HXWZBBVZZQVGHI-UHFFFAOYSA-N
Molecular Weight 220.29
Solvent Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Bruker HX-270
Synonyms VALERIC ACID, 2-HYDROXY-2-/METHYL- THIO/-, METHYL ESTER, ACETATE