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Estra-1,3,5(10)-trien-17-ol, 3-methoxy-14-methyl-, (14.beta.,17.beta.)-
SpectraBase Compound ID 4a3q3JjGgK8
InChI InChI=1S/C20H28O2/c1-19-11-9-18(21)20(19,2)10-8-16-15-6-5-14(22-3)12-13(15)4-7-17(16)19/h5-6,12,16-18,21H,4,7-11H2,1-3H3/t16-,17-,18+,19-,20-/m1/s1
InChIKey MSXSBTQDHYRELD-OUUBHVDSSA-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 37dBtos2UQg
Name Estra-1,3,5(10)-trien-17-ol, 3-methoxy-14-methyl-, (14.beta.,17.beta.)-
Alternate Name(s) (14beta,17beta)-3-methoxy-14-methylestra-1,3,5(10)-trien-17-ol 14-Methyl-14.beta.-estra-1,3,5(10)-triene-17.beta.-ol 3-methyl ether
CAS Registry Number 109429-82-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H28O2
InChI InChI=1S/C20H28O2/c1-19-11-9-18(21)20(19,2)10-8-16-15-6-5-14(22-3)12-13(15)4-7-17(16)19/h5-6,12,16-18,21H,4,7-11H2,1-3H3/t16-,17-,18+,19-,20-/m1/s1
InChIKey MSXSBTQDHYRELD-OUUBHVDSSA-N
Molecular Weight 300.442 g/mol
SMILES O[C@@]1([C@@]2([C@@]([C@]3([C@@](c4ccc(cc4CC3)OC)(CC2)[H])[H])(CC1)C)C)[H]
SPLASH splash10-0uki-0943000000-9b8f5ff576aa6c66298e
Source of Spectrum KC-1987-42-24
Wiley ID 1303359