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

*Links on SpectraBase are not permalinks.
3-METHOXY-19-HYDROXYANDROST-5-ENE, 17,17-ETHYLENEDIOXY-, MONO-DEUTERO-
SpectraBase Compound ID 6deXXXl5jc1
InChI InChI=1S/C22H34O4/c1-20-8-6-19-17(18(20)7-10-22(20)25-11-12-26-22)4-3-15-13-16(24-2)5-9-21(15,19)14-23/h3,16-19,23H,4-14H2,1-2H3/t16?,17-,18-,19-,20-,21+/m0/s1
InChIKey NAUDYDDYPXFUMU-RDQPJNLGSA-N
Mol Weight 362.5 g/mol
Molecular Formula C22H34O4
Exact Mass 362.24571 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 t4qW1PwBs6
Name 3-METHOXY-19-HYDROXYANDROST-5-ENE, 17,17-ETHYLENEDIOXY-, MONO-DEUTERO-
Copyright Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 362.245709571 u
Formula C22H34O4
InChI InChI=1S/C22H34O4/c1-20-8-6-19-17(18(20)7-10-22(20)25-11-12-26-22)4-3-15-13-16(24-2)5-9-21(15,19)14-23/h3,16-19,23H,4-14H2,1-2H3/t16?,17-,18-,19-,20-,21+/m0/s1
InChIKey NAUDYDDYPXFUMU-RDQPJNLGSA-N
Molecular Weight 362.510 g/mol
Nominal Mass 362 u
Number of Peaks 270
SMILES OC[C@@]12[C@]3(CC[C@@]4(C5(CC[C@]4([C@@]3(CC=C1CC(CC2)OC)[H])[H])OCCO5)C)[H]
SPLASH splash10-000j-9771000000-2b1416303b6890f5fe3c
Source File Reference LMCM-86799-494M
Source of Spectrum Prof. J. Seibl; ETH Zurich, Switzerland
Synonyms mono-deutero-(1'S,2'S,10'R,11'S,15'S)-5'-methoxy-15'-methylspiro[1,3-dioxolane-2,14'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan]-7'-en-2'-ylmethanol
Wiley ID 8_14544