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

*Links on SpectraBase are not permalinks.
(Z)-5-[(AS)-4-METHYL-CYClOHEXYLIDENE]-3-PENTEN-2-ONE;VITAMIN-D-DERIVATIVE
SpectraBase Compound ID ACIPelXYNxp
InChI InChI=1S/C12H18O/c1-10-6-8-12(9-7-10)5-3-4-11(2)13/h3-5,10H,6-9H2,1-2H3/b4-3-,12-5-/t10-/m0/s1
InChIKey PMAJVAGBMCMZKI-JSGHUBKBSA-N
Mol Weight 178.27 g/mol
Molecular Formula C12H18O
Exact Mass 178.135765 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 8XKSimZSADD
Name (Z)-5-[(AS)-4-METHYL-CYClOHEXYLIDENE]-3-PENTEN-2-ONE;VITAMIN-D-DERIVATIVE
CAS Registry Number 102633-33-0
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H18O
InChI InChI=1S/C12H18O/c1-10-6-8-12(9-7-10)5-3-4-11(2)13/h3-5,10H,6-9H2,1-2H3/b4-3-,12-5-/t10-/m0/s1
InChIKey PMAJVAGBMCMZKI-JSGHUBKBSA-N
Literature Reference Author J.K.GAWRONSKI,H.M.WALBORSKY
Literature Reference Citation J.ORG.CHEM.,51,2863(1986)
Literature Reference DOI 10.1021/jo00365a002
Molecular Weight 178.274 g/mol
Solvent CDCl3
Source File Reference UWWR5118