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

*Links on SpectraBase are not permalinks.
(1S,2R)-4-[(E,3S)-3-hydroxybut-1-enyl]-3,5,5-trimethylcyclohex-3-ene-1,2-diol
SpectraBase Compound ID 1noP296vLMp
InChI InChI=1S/C13H22O3/c1-8(14)5-6-10-9(2)12(16)11(15)7-13(10,3)4/h5-6,8,11-12,14-16H,7H2,1-4H3/b6-5+/t8-,11-,12+/m0/s1
InChIKey HODWUFMHAGVDJY-LLGUPFCTSA-N
Mol Weight 226.32 g/mol
Molecular Formula C13H22O3
Exact Mass 226.156895 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 HJ3vKPxhym5
Name (1S,2R)-4-[(E,3S)-3-hydroxybut-1-enyl]-3,5,5-trimethylcyclohex-3-ene-1,2-diol
Compound Number 7A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C13H22O3
InChI InChI=1S/C13H22O3/c1-8(14)5-6-10-9(2)12(16)11(15)7-13(10,3)4/h5-6,8,11-12,14-16H,7H2,1-4H3/b6-5+/t8-,11-,12+/m0/s1
InChIKey HODWUFMHAGVDJY-LLGUPFCTSA-N
Literature Reference Author Q.YU,K.MATSUNAMI,H.OTSUKA,Y.TAKEDA
Literature Reference Citation CHEM.PHARM.BULL.,53,800(2005)
Literature Reference DOI 10.1248/cpb.53.800
Molecular Weight 226.316 g/mol
Sample ID 54056
Solvent CD3OD