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(+,-)-7(8->11)abeo-estra-1,3,5(10),9(11)-tetraene-3,17b-diol
SpectraBase Compound ID C3n6Y0KdduP
InChI InChI=1S/C18H22O2/c1-18-10-12-3-2-11-8-14(19)5-6-15(11)16(12)9-13(18)4-7-17(18)20/h5-6,8,13,17,19-20H,2-4,7,9-10H2,1H3/t13?,17-,18-/m0/s1
InChIKey RKLMDGGTFYWSCU-RHGDZWTLSA-N
Mol Weight 270.37 g/mol
Molecular Formula C18H22O2
Exact Mass 270.16198 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GNJw3dwV0LB
Name (+,-)-7(8->11)abeo-estra-1,3,5(10),9(11)-tetraene-3,17b-diol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H22O2
InChI InChI=1S/C18H22O2/c1-18-10-12-3-2-11-8-14(19)5-6-15(11)16(12)9-13(18)4-7-17(18)20/h5-6,8,13,17,19-20H,2-4,7,9-10H2,1H3/t13?,17-,18-/m0/s1
InChIKey RKLMDGGTFYWSCU-RHGDZWTLSA-N
Molecular Weight 270.372 g/mol
SMILES O[C@]1(CCC2[C@@]1(CC1=C(c3ccc(cc3CC1)O)C2)C)[H]
SPLASH splash10-05fr-0490000000-380086b2f1a9f163003c
Source of Spectrum B-45-71-0
Synonyms (7aS,8S)-7a-methyl-6,7,7a,8,9,10,10a,11-octahydro-5H-cyclopenta[b]phenanthrene-3,8-diol
Wiley ID 1274810