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3-Methoxy-Estra-1,3,5(10)-triene
SpectraBase Compound ID JnUyX871rYv
InChI InChI=1S/C19H26O/c1-19-10-3-4-18(19)17-7-5-13-12-14(20-2)6-8-15(13)16(17)9-11-19/h6,8,12,16-18H,3-5,7,9-11H2,1-2H3/t16-,17-,18+,19+/m1/s1
InChIKey UHDFDVNBHMUVOO-YRXWBPOGSA-N
Mol Weight 270.42 g/mol
Molecular Formula C19H26O
Exact Mass 270.198365 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 34kIT0iWdw1
Name 3-Methoxy-Estra-1,3,5(10)-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H26O
InChI InChI=1S/C19H26O/c1-19-10-3-4-18(19)17-7-5-13-12-14(20-2)6-8-15(13)16(17)9-11-19/h6,8,12,16-18H,3-5,7,9-11H2,1-2H3/t16-,17-,18+,19+/m1/s1
InChIKey UHDFDVNBHMUVOO-YRXWBPOGSA-N
Molecular Weight 270.416 g/mol
SMILES [C@]12([H])CCC[C@@]2(C)CC[C@@]2(c3c(CC[C@@]12[H])cc(OC)cc3)[H]
SPLASH splash10-00di-0490000000-3c0f7e0ef6c0ff633993
Source of Spectrum K-104-2399-1f
Synonyms (8S,9S,13S,14S)-3-methoxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthrene
Wiley ID 1793431