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

*Links on SpectraBase are not permalinks.

(+/-)-(1S*,3S*)-3-HYDROXYMETHYL-5-OXO-CYCLOHEXYL-CARBOXYLIC-ACID

Compound with spectra: 1 NMR, and 1 MS (GC)

(+/-)-(1S*,3S*)-3-HYDROXYMETHYL-5-OXO-CYCLOHEXYL-CARBOXYLIC-ACID
SpectraBase Compound ID 92C8GQPzeBp
InChI InChI=1S/C8H12O4/c9-4-5-1-6(8(11)12)3-7(10)2-5/h5-6,9H,1-4H2,(H,11,12)/t5-,6-/m0/s1
InChIKey AWEIERBVWHIOAF-WDSKDSINSA-N
Mol Weight 172.18 g/mol
Molecular Formula C8H12O4
Exact Mass 172.073559 g/mol
Enantiomer InChIKey AWEIERBVWHIOAF-PHDIDXHHSA-N

View Spectrum of (+/-)-(1S*,3S*)-3-HYDROXYMETHYL-5-OXO-CYCLOHEXYL-CARBOXYLIC-ACID

MS (GC) Spectrum
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Source of Spectrum F-45-1400-6

View Spectrum of (+/-)-(1S*,3S*)-3-HYDROXYMETHYL-5-OXO-CYCLOHEXYL-CARBOXYLIC-ACID

13C NMR Spectrum
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent CD3OD
  • (1S,3S)-3-(hydroxymethyl)-5-oxidanylidene-cyclohexane-1-carboxylic acid
Ethyl 3-oxo-cyclohexane-1-carboxylate
Methyl 3-oxo-cycloheptane-1-carboxylate
3,3-Dimethyl-4-oxocyclopentanecarboxylic acid
trans-1,3-Dicarbomethoxy-cyclohexane
Cyclopentanecarboxylic acid, 3-(hydroxymethyl)-, 1,1-dimethylethyl ester
Cyclohexanecarboxylic acid, 3-(trifluoromethyl)-, cis-
3-cis-Carbomethoxy-cyclohexanepropanol
2,2-Dimethyl-4-oxocyclopentan-1-carbonsaure
Bicyclo[3.3.1]nonan-3-one, 7-[(acetyloxy)methyl]-, endo-
INDENE-CARBOXYLIC-ACID
Title Journal or Book Year
A versatile regio- and stereospecific annulation method - II Tetrahedron 1989
Other Resources
Unknown Identification

Search your unknown spectrum against the world's largest collection of reference spectra

KnowItAll Campus Solutions

KnowItAll offers faculty and students at your school access to all the tools you need for spectral analysis and structure drawing & publishing! Plus, access the world's largest spectral library.