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Estrone 3-methyl ether

View entire compound with spectra: 2 NMR, 3 FTIR, 2 Raman, and 1 MS (GC)

Estrone 3-methyl ether
SpectraBase Compound ID JiZUsTkPtoU
InChI InChI=1S/C19H24O2/c1-19-10-9-15-14-6-4-13(21-2)11-12(14)3-5-16(15)17(19)7-8-18(19)20/h4,6,11,15-17H,3,5,7-10H2,1-2H3/t15-,16-,17+,19+/m1/s1
InChIKey BCWWDWHFBMPLFQ-VXNCWWDNSA-N
Mol Weight 284.4 g/mol
Molecular Formula C19H24O2
Exact Mass 284.17763 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3GaNLzqxjfZ
Name 3-METHOXYESTRA-1,3,5(10)-TRIEN-17-ON
Compound Number 370
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H24O2
InChI InChI=1S/C19H24O2/c1-19-10-9-15-14-6-4-13(21-2)11-12(14)3-5-16(15)17(19)7-8-18(19)20/h4,6,11,15-17H,3,5,7-10H2,1-2H3/t15-,16-,17+,19+/m1/s1
InChIKey BCWWDWHFBMPLFQ-VXNCWWDNSA-N
Literature Reference Author J.W.BLUNT,J.B.STOTHERS
Literature Reference Citation ORG.MAGN.RES.,9,439(1977)
Literature Reference DOI 10.1002/mrc.1270090802
Molecular Weight 284.398 g/mol
Solvent DIOXANE
Source File Reference UNIW81