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

*Links on SpectraBase are not permalinks.
3-HYDROXY-9,10-SECO-PREGNA-1,3,5(10)-TRIENE-9,10-DIONE
SpectraBase Compound ID 872bYzR4mG4
InChI InChI=1S/C21H28O3/c1-13-4-6-16(23)12-15(13)5-7-17-19-9-8-18(14(2)22)21(19,3)11-10-20(17)24/h4,6,12,17-19,23H,5,7-11H2,1-3H3/t17-,18+,19-,21+/m0/s1
InChIKey ZIQBRQPDQCLYNC-YOUFYPILSA-N
Mol Weight 328.45 g/mol
Molecular Formula C21H28O3
Exact Mass 328.203845 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 CqcFvGAoJ1a
Name 3-HYDROXY-9,10-SECO-PREGNA-1,3,5(10)-TRIENE-9,10-DIONE
Compound Number 10
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C21H28O3
InChI InChI=1S/C21H28O3/c1-13-4-6-16(23)12-15(13)5-7-17-19-9-8-18(14(2)22)21(19,3)11-10-20(17)24/h4,6,12,17-19,23H,5,7-11H2,1-3H3/t17-,18+,19-,21+/m0/s1
InChIKey ZIQBRQPDQCLYNC-YOUFYPILSA-N
Literature Reference Author A.POLLIO,G.PINTO,M.D.GRECA,A.D.MAIO,A.FIORENTINO,L.PREVITERA
Literature Reference Citation PHYTOCHEM.,37,1269(1994)
Literature Reference DOI 10.1016/S0031-9422(00)90396-0
Molecular Weight 328.452 g/mol
Solvent CDCl3
Source File Reference UWMS23454