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3-Methoxy-11-methyl-estra-1,3,5(10),8(14).9(11),15-hexaen-17-one
SpectraBase Compound ID LC1Mq8IPmHO
InChI InChI=1S/C20H20O2/c1-12-11-20(2)17(8-9-18(20)21)16-6-4-13-10-14(22-3)5-7-15(13)19(12)16/h5,7-10H,4,6,11H2,1-3H3/t20-/m0/s1
InChIKey NGYWJHCSJNETSC-FQEVSTJZSA-N
Mol Weight 292.38 g/mol
Molecular Formula C20H20O2
Exact Mass 292.14633 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID nq1UlUWdpb
Name 3-Methoxy-11-methyl-estra-1,3,5(10),8(14).9(11),15-hexaen-17-one
Alternate Name(s) 3-Methoxy-11-methylestra-1,3,5(10),8(14),9(11),15-hexaen-17-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20O2
InChI InChI=1S/C20H20O2/c1-12-11-20(2)17(8-9-18(20)21)16-6-4-13-10-14(22-3)5-7-15(13)19(12)16/h5,7-10H,4,6,11H2,1-3H3/t20-/m0/s1
InChIKey NGYWJHCSJNETSC-FQEVSTJZSA-N
Molecular Weight 292.378 g/mol
SMILES C12=C3[C@](C(=O)C=C3)(C)CC(=C1c1ccc(cc1CC2)OC)C
SPLASH splash10-0006-2190000000-e236c13e260fe16787f3
Source of Spectrum AC-133-578-13
Wiley ID 812242