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rac-(8.alpha.,9.alpha.,13.alpha.,14.alpha.,17.beta.)-3-Methoxyestra-1(10),2,4,6-tetraene-14,17-diol
SpectraBase Compound ID 4ckYBkH7bd1
InChI InChI=1S/C19H24O3/c1-18-9-7-15-14-5-4-13(22-2)11-12(14)3-6-16(15)19(18,21)10-8-17(18)20/h3-6,11,15-17,20-21H,7-10H2,1-2H3/t15-,16+,17+,18+,19-/m1/s1
InChIKey MTHGAUZBQUWFCS-HVMFNXBNSA-N
Mol Weight 300.4 g/mol
Molecular Formula C19H24O3
Exact Mass 300.172545 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B8Fo8J8qBZ
Name rac-(8.alpha.,9.alpha.,13.alpha.,14.alpha.,17.beta.)-3-Methoxyestra-1(10),2,4,6-tetraene-14,17-diol
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Formula C19H24O3
InChI InChI=1S/C19H24O3/c1-18-9-7-15-14-5-4-13(22-2)11-12(14)3-6-16(15)19(18,21)10-8-17(18)20/h3-6,11,15-17,20-21H,7-10H2,1-2H3/t15-,16+,17+,18+,19-/m1/s1
InChIKey MTHGAUZBQUWFCS-HVMFNXBNSA-N
Molecular Weight 300.398 g/mol
SMILES O[C@@]1([C@]2([C@]([C@@]3([C@](CC2)(c2ccc(cc2C=C3)OC)[H])[H])(CC1)O)C)[H]
SPLASH splash10-0a4i-1901000000-8fa1d6de9e0c98b54eaa
Source of Spectrum QC-21-1608-11c
Wiley ID 1688401