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Estra-1,3,5(10)-trien-15-ol, 3-methoxy-15-methyl-, (14.beta.,15.alpha.)-
SpectraBase Compound ID CUoM6kH3VsD
InChI InChI=1S/C20H28O2/c1-19-9-8-16-15-7-5-14(22-3)12-13(15)4-6-17(16)18(19)20(2,21)11-10-19/h5,7,12,16-18,21H,4,6,8-11H2,1-3H3/t16-,17-,18-,19-,20?/m1/s1
InChIKey AXMHMHBCGDTZNU-MGXUXCEGSA-N
Mol Weight 300.44 g/mol
Molecular Formula C20H28O2
Exact Mass 300.20893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GtVtBIL96ZN
Name Estra-1,3,5(10)-trien-15-ol, 3-methoxy-15-methyl-, (14.beta.,15.alpha.)-
Alternate Name(s) (14beta)-3-methoxy-15-methylestra-1,3,5(10)-trien-15-ol 3-Methoxy-15-hydroxy-15-methyl-14.beta.-setra-1,3,5(10)-triene
CAS Registry Number 109327-61-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O2
InChI InChI=1S/C20H28O2/c1-19-9-8-16-15-7-5-14(22-3)12-13(15)4-6-17(16)18(19)20(2,21)11-10-19/h5,7,12,16-18,21H,4,6,8-11H2,1-3H3/t16-,17-,18-,19-,20?/m1/s1
InChIKey AXMHMHBCGDTZNU-MGXUXCEGSA-N
Molecular Weight 300.442 g/mol
SMILES OC1([C@@]2([C@]3([C@@](c4ccc(cc4CC3)OC)(CC[C@@]2(CC1)C)[H])[H])[H])C
SPLASH splash10-0019-0982000000-32708c77b59784085c7a
Source of Spectrum KC-1987-41-11
Wiley ID 1303358