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 |