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3-Methoxy-estra-1,3,5(10)-trien-16-one
SpectraBase Compound ID BCSFXwnpGnS
InChI InChI=1S/C19H24O2/c1-19-8-7-16-15-6-4-14(21-2)9-12(15)3-5-17(16)18(19)10-13(20)11-19/h4,6,9,16-18H,3,5,7-8,10-11H2,1-2H3
InChIKey MLIUKDPBZGBAJC-UHFFFAOYSA-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 86p23BtuHVX
Name 3-Methoxy-estra-1,3,5(10)-trien-16-one
CAS Registry Number 6038-22-8
Comments reassigned
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Formula C19H24O2
InChI InChI=1S/C19H24O2/c1-19-8-7-16-15-6-4-14(21-2)9-12(15)3-5-17(16)18(19)10-13(20)11-19/h4,6,9,16-18H,3,5,7-8,10-11H2,1-2H3
InChIKey MLIUKDPBZGBAJC-UHFFFAOYSA-N
Instrument Name Varian HA-100
Literature Reference T.A. Wittstruck, K.I. Williams, J. Org. Chem. 38, 1542 (1973).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent Dioxane