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

*Links on SpectraBase are not permalinks.
22-(Benzyloxy)-3.beta.-[(t-butyldimethylsilyl)oxy]-5.alpha.-23,24-bisnorcholan-16-one
SpectraBase Compound ID 8NBYiQs8zO4
InChI InChI=1S/C35H56O3Si/c1-24(22-37-23-25-12-10-9-11-13-25)32-31(36)21-30-28-15-14-26-20-27(38-39(7,8)33(2,3)4)16-18-34(26,5)29(28)17-19-35(30,32)6/h9-13,24,26-30,32H,14-23H2,1-8H3/t24-,26+,27+,28-,29+,30-,32?,34+,35+/m1/s1
InChIKey IEDGVYDIOCSIJU-UBDMGZGMSA-N
Mol Weight 552.9 g/mol
Molecular Formula C35H56O3Si
Exact Mass 552.399872 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 E7GNfcaiLEk
Name 22-(Benzyloxy)-3.beta.-[(t-butyldimethylsilyl)oxy]-5.alpha.-23,24-bisnorcholan-16-one
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C35H56O3Si
InChI InChI=1S/C35H56O3Si/c1-24(22-37-23-25-12-10-9-11-13-25)32-31(36)21-30-28-15-14-26-20-27(38-39(7,8)33(2,3)4)16-18-34(26,5)29(28)17-19-35(30,32)6/h9-13,24,26-30,32H,14-23H2,1-8H3/t24-,26+,27+,28-,29+,30-,32?,34+,35+/m1/s1
InChIKey IEDGVYDIOCSIJU-UBDMGZGMSA-N
Molecular Weight 552.915 g/mol
SMILES [C@@]12([C@@]([C@@]3(CC[C@@]4([C@@]([C@]3(CC2)[H])(CC[C@](O[Si](C(C)(C)C)(C)C)(C4)[H])C)[H])[H])(CC(C1[C@@](COCc1ccccc1)(C)[H])=O)[H])C
SPLASH splash10-0002-0000900000-2298f9023d99baabaea8
Source of Spectrum U1-1999-3508-13
Synonyms (2S,7S,15S)-14-[(2S)-1-(benzyloxy)propan-2-yl]-5-[(tert-butyldimethylsilyl)oxy]-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-13-one
Wiley ID 815023