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3-Hydroxyergost-7-ene
SpectraBase Compound ID 7bmCy7sjkmV
InChI InChI=1S/C31H56OSi/c1-21(2)22(3)10-11-23(4)27-14-15-28-26-13-12-24-20-25(32-33(7,8)9)16-18-30(24,5)29(26)17-19-31(27,28)6/h13,21-25,27-29H,10-12,14-20H2,1-9H3/t22-,23+,24?,25?,27+,28-,29-,30-,31+/m0/s1
InChIKey TVNDUGAVWGGIBH-ZTCMEWISSA-N
Mol Weight 472.9 g/mol
Molecular Formula C31H56OSi
Exact Mass 472.410043 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D4qFjU31k5Z
Name 3-Hydroxyergost-7-ene
CAS Registry Number 18880-54-1
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 472.410042957 u
Formula C31H56OSi
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C31H56OSi/c1-21(2)22(3)10-11-23(4)27-14-15-28-26-13-12-24-20-25(32-33(7,8)9)16-18-30(24,5)29(26)17-19-31(27,28)6/h13,21-25,27-29H,10-12,14-20H2,1-9H3/t22-,23+,24?,25?,27+,28-,29-,30-,31+/m0/s1
InChIKey TVNDUGAVWGGIBH-ZTCMEWISSA-N
Molecular Weight 472.873 g/mol
Nominal Mass 472 u
Number of Peaks 363
SMILES C1(CC[C@@]2([C@]3(CC[C@@]4([C@](CC[C@]4(C3=CCC2C1)[H])([C@@](CC[C@](C)(C(C)C)[H])(C)[H])[H])C)[H])C)O[Si](C)(C)C
SPLASH splash10-0ab9-7951300000-faef83fb29b5e9ca1cdd
Source Fungus L. sulphureus
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Wiley ID VI001968