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Ergosta-4,24(28)-dien-3-one

View entire compound with spectra: 3 MS (GC)

Ergosta-4,24(28)-dien-3-one
SpectraBase Compound ID 7I3ES6bMRYQ
InChI InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h17-18,20,23-26H,3,7-16H2,1-2,4-6H3
InChIKey JRMPVNVOLQJLJX-UHFFFAOYSA-N
Mol Weight 396.7 g/mol
Molecular Formula C28H44O
Exact Mass 396.339216 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AJDbgzlxvcB
Name Ergsta-4,24(28)-dien-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H44O
InChI InChI=1S/C28H44O/c1-18(2)19(3)7-8-20(4)24-11-12-25-23-10-9-21-17-22(29)13-15-27(21,5)26(23)14-16-28(24,25)6/h17-18,20,23-26H,3,7-16H2,1-2,4-6H3
InChIKey JRMPVNVOLQJLJX-UHFFFAOYSA-N
Ionization Type EI-B
Molecular Weight 396.659 g/mol
SMILES CC12C(C(C)CCC(C(C)C)=C)CCC2C2C(CC1)C1(C)C(CC2)=CC(CC1)=O
SPLASH splash10-03dj-9886000000-13fa23fc78b5ee7320d8
Source of Spectrum SRH-2022-9507-0
Wiley ID 1831164