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

*Links on SpectraBase are not permalinks.
CAESALPIN_D;1-ALPHA-ACETOXY-7-OXO-14-METHYLVOUCAPANE-5-(6),8-(14),9-(11)-DIENE
SpectraBase Compound ID JkXHgMtREIS
InChI InChI=1S/C22H24O4/c1-12-14-7-9-25-17(14)10-15-20(12)16(24)11-18-21(3,4)8-6-19(22(15,18)5)26-13(2)23/h7,9-11,19H,6,8H2,1-5H3/t19-,22+/m0/s1
InChIKey XPACHSSSEPPAJH-SIKLNZKXSA-N
Mol Weight 352.43 g/mol
Molecular Formula C22H24O4
Exact Mass 352.167459 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 F7INvjcYlNM
Name CAESALPIN_D;1-ALPHA-ACETOXY-7-OXO-14-METHYLVOUCAPANE-5-(6),8-(14),9-(11)-DIENE
Compound Number 4
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H24O4
InChI InChI=1S/C22H24O4/c1-12-14-7-9-25-17(14)10-15-20(12)16(24)11-18-21(3,4)8-6-19(22(15,18)5)26-13(2)23/h7,9-11,19H,6,8H2,1-5H3/t19-,22+/m0/s1
InChIKey XPACHSSSEPPAJH-SIKLNZKXSA-N
Literature Reference Author G.MA,J.YUAN,H.WU,L.CAO,X.ZHANG,L.XU,H.WEI,L.WU,Q.ZHENG,L.LI, L.ZHANG,J.YANG,X.XU
Literature Reference Citation J.NAT.PROD.,76,1025(2013)
Literature Reference DOI 10.1021/np300918q
Molecular Weight 352.430 g/mol
Sample ID 42577
Solvent CDCl3