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

*Links on SpectraBase are not permalinks.

(1R,3S,4S,5R)-3,5-Diacetoxy-4-methyl-cyclohexanecarboxylic acid methyl ester

View entire compound with spectra: 1 MS (GC)

(1R,3S,4S,5R)-3,5-Diacetoxy-4-methyl-cyclohexanecarboxylic acid methyl ester
SpectraBase Compound ID iryA9keZh2
InChI InChI=1S/C13H20O6/c1-7-11(18-8(2)14)5-10(13(16)17-4)6-12(7)19-9(3)15/h7,10-12H,5-6H2,1-4H3/t7-,10+,11-,12+
InChIKey OLTKUGLGEHYWAY-YLJMFYFWSA-N
Mol Weight 272.3 g/mol
Molecular Formula C13H20O6
Exact Mass 272.125988 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 FA5Z3IBv3rX
Name (1R,3S,4S,5R)-3,5-Diacetoxy-4-methyl-cyclohexanecarboxylic acid methyl ester
Alternate Name(s) cis,cis-3,5-Diacetoxy-4-methyl-1-(methoxycarbonyl)cyclohexane Methyl (3R,5S)-3,5-bis(acetyloxy)-4-methylcyclohexanecarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H20O6
InChI InChI=1S/C13H20O6/c1-7-11(18-8(2)14)5-10(13(16)17-4)6-12(7)19-9(3)15/h7,10-12H,5-6H2,1-4H3/t7-,10+,11-,12+
InChIKey OLTKUGLGEHYWAY-YLJMFYFWSA-N
Molecular Weight 272.297 g/mol
SMILES [C@@]1([C@]([C@](OC(=O)C)(C[C@](C1)(C(=O)OC)[H])[H])(C)[H])(OC(=O)C)[H]
SPLASH splash10-0006-9500000000-389fc9259666d2a54b00
Source of Spectrum QC-11-3895-18
Wiley ID 860140