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3-Methoxy-17.beta.-methylestra-2,5(10)-diene
SpectraBase Compound ID LbljKIvpmbI
InChI InChI=1S/C20H30O/c1-13-4-9-19-18-7-5-14-12-15(21-3)6-8-16(14)17(18)10-11-20(13,19)2/h6,13,17-19H,4-5,7-12H2,1-3H3/t13-,17+,18+,19-,20+/m0/s1
InChIKey NSTXBXNIVBRLJX-WWYBLAPGSA-N
Mol Weight 286.46 g/mol
Molecular Formula C20H30O
Exact Mass 286.229666 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FwGMFYMYr0p
Name 3-Methoxy-17.beta.-methylestra-2,5(10)-diene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H30O
InChI InChI=1S/C20H30O/c1-13-4-9-19-18-7-5-14-12-15(21-3)6-8-16(14)17(18)10-11-20(13,19)2/h6,13,17-19H,4-5,7-12H2,1-3H3/t13-,17+,18+,19-,20+/m0/s1
InChIKey NSTXBXNIVBRLJX-WWYBLAPGSA-N
Molecular Weight 286.459 g/mol
SMILES C1=2[C@@]3([C@@]([C@@]4(CC[C@@]([C@]4(CC3)C)(C)[H])[H])([H])CCC2CC(=CC1)OC)[H]
SPLASH splash10-00dr-0960000000-e94d3a0ae92f294fab16
Source of Spectrum U1-2011-4546-7
Wiley ID 1665795