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

*Links on SpectraBase are not permalinks.
17-(Acetyloxy)-19-hydroxy-4,4-dimethylandrostan-3-yl acetate
SpectraBase Compound ID 6HL82hpvLTe
InChI InChI=1S/C25H40O5/c1-15(27)29-21-11-13-25(14-26)19-10-12-24(5)18(7-9-22(24)30-16(2)28)17(19)6-8-20(25)23(21,3)4/h17-22,26H,6-14H2,1-5H3/t17?,18?,19?,20?,21?,22?,24-,25-/m0/s1
InChIKey CUHLJDZLMKDSIY-VBGHOJQDSA-N
Mol Weight 420.6 g/mol
Molecular Formula C25H40O5
Exact Mass 420.287574 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 Fb8OpzOygIt
Name 17-(ACETYLOXY)-19-HYDROXY-4,4-DIMETHYLANDROSTAN-3-YL ACETATE
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 420.287574383 u
Formula C25H40O5
InChI InChI=1S/C25H40O5/c1-15(27)29-21-11-13-25(14-26)19-10-12-24(5)18(7-9-22(24)30-16(2)28)17(19)6-8-20(25)23(21,3)4/h17-22,26H,6-14H2,1-5H3/t17?,18?,19?,20?,21?,22?,24-,25-/m0/s1
InChIKey CUHLJDZLMKDSIY-VBGHOJQDSA-N
Molecular Weight 420.590 g/mol
Nominal Mass 420 u
Number of Peaks 304
SMILES OC[C@@]12C3CC[C@@]4(C(CCC4C3CCC1C(C(CC2)OC(C)=O)(C)C)OC(=O)C)C
SPLASH splash10-00nf-8954000000-e59768f8ffbe73ad4b7a
Source File Reference LMCM-53460-786X
Source of Spectrum Prof. J. Seibl; ETH Zurich, Switzerland
Synonyms (2S,15S)-5-(acetyloxy)-2-(hydroxymethyl)-6,6,15-trimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan-14-yl acetate
Wiley ID 8_12704