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

*Links on SpectraBase are not permalinks.

Pregn-9(11)-ene-3,18.20-triol, triacetate

View entire compound with spectra: 2 MS (GC)

Pregn-9(11)-ene-3,18.20-triol, triacetate
SpectraBase Compound ID JuXxjUyaXNl
InChI InChI=1S/C27H40O6/c1-16(32-18(3)29)23-8-9-25-22-7-6-20-14-21(33-19(4)30)10-12-26(20,5)24(22)11-13-27(23,25)15-31-17(2)28/h11,16,20-23,25H,6-10,12-15H2,1-5H3
InChIKey GOAAHSIFJRXXGL-UHFFFAOYSA-N
Mol Weight 460.6 g/mol
Molecular Formula C27H40O6
Exact Mass 460.282489 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID E2vBQX62sXT
Name
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C27H40O6
InChI InChI=1S/C27H40O6/c1-16(32-18(3)29)23-8-9-25-22-7-6-20-14-21(33-19(4)30)10-12-26(20,5)24(22)11-13-27(23,25)15-31-17(2)28/h11,16,20-23,25H,6-10,12-15H2,1-5H3
InChIKey GOAAHSIFJRXXGL-UHFFFAOYSA-N
Molecular Weight 460.2814
SMILES C1(OC(=O)C)CC2C(C)(C3=CCC4(COC(=O)C)C(C(OC(=O)C)C)CCC4C3CC2)CC1
SPLASH splash10-0006-6934000000-d689a681cd89f7232af0
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany