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

*Links on SpectraBase are not permalinks.
Ergosta-5,22-dien-3-ol -H2O         @
SpectraBase Compound ID 2HbkD92noVn
InChI InChI=1S/C28H44/c1-19(2)20(3)10-11-21(4)24-14-15-25-23-13-12-22-9-7-8-17-27(22,5)26(23)16-18-28(24,25)6/h7,9-12,19-21,23-26H,8,13-18H2,1-6H3/b11-10+
InChIKey VEQSWCXLXGRGCT-ZHACJKMWSA-N
Mol Weight 380.7 g/mol
Molecular Formula C28H44
Exact Mass 380.344301 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 CsvEYXD6cqL
Name Ergosta-5,22-dien-3-ol -H2O @
Classification Plant sterol
Copyright Copyright © 2023-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 380.344301417 u
Formula C28H44
InChI InChI=1S/C28H44/c1-19(2)20(3)10-11-21(4)24-14-15-25-23-13-12-22-9-7-8-17-27(22,5)26(23)16-18-28(24,25)6/h7,9-12,19-21,23-26H,8,13-18H2,1-6H3/b11-10+
InChIKey VEQSWCXLXGRGCT-ZHACJKMWSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 380.660 g/mol
SMILES C12(C(C3CC=C4C(C3CC2)(CCC=C4)C)CCC1C(\C=C\C(C(C)C)C)C)C
SPLASH splash10-053r-6922000000-e23bf004b9494fa57c67
Sample Comments The MMPW Reference Handbook and associated Tables are attached to Record #1, under the Attachments tab. Refer to these references for an explanation of the Sample Preparation Procedure "Detected" abbreviations, as well as other relevant information pertaining to this database.
Source of Spectrum H.H.Maurer, M.Meyer, K.Pfleger, A.A. Weber / University of Saarland, D-66424 Homburg Germany
Synonyms Crinosterol -H2O Ergosta-3,5,22-triene
Technique GC/MS
Wiley ID MMPW6e_5623