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

*Links on SpectraBase are not permalinks.
3-Cyclohexene-1-carbothioic acid, 3-hydroxy-5-oxo-4-(1-oxobutyl)-,S-methyl ester
SpectraBase Compound ID 9RqyjgglUtH
InChI InChI=1S/C12H16O4S/c1-3-4-8(13)11-9(14)5-7(6-10(11)15)12(16)17-2/h7,14H,3-6H2,1-2H3
InChIKey AGRIMNFYEQHBMD-UHFFFAOYSA-N
Mol Weight 256.32 g/mol
Molecular Formula C12H16O4S
Exact Mass 256.07693 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

View the Full Spectrum for FREE!

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

SpectraBase Spectrum ID KAIr1wQlm15
Name 3-Cyclohexene-1-carbothioic acid, 3-hydroxy-5-oxo-4-(1-oxobutyl)-,S-methyl ester
CAS Registry Number 120074-05-7
Copyright Copyright © 1989, 1990-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C12H16O4S
InChI InChI=1S/C12H16O4S/c1-3-4-8(13)11-9(14)5-7(6-10(11)15)12(16)17-2/h7,14H,3-6H2,1-2H3
InChIKey AGRIMNFYEQHBMD-UHFFFAOYSA-N
Instrument Name Bruker IFS 88 C
Technique KBr-Pellet