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4-METHYLESTRA-1,3,5(10)-TRIEN-6,17-DION

View entire compound with spectra: 2 NMR

4-METHYLESTRA-1,3,5(10)-TRIEN-6,17-DION
SpectraBase Compound ID D2X6lTmtnHo
InChI InChI=1S/C19H22O2/c1-11-4-3-5-13-12-8-9-19(2)15(6-7-17(19)21)14(12)10-16(20)18(11)13/h3-5,12,14-15H,6-10H2,1-2H3/t12-,14-,15+,19+/m1/s1
InChIKey IGEVSLBEVLLNTP-IBWPGLOJSA-N
Mol Weight 282.38 g/mol
Molecular Formula C19H22O2
Exact Mass 282.16198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4bQWWr2KS45
Name 4-METHYLESTRA-1,3,5(10)-TRIEN-6,17-DION
Compound Number 411
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H22O2
InChI InChI=1S/C19H22O2/c1-11-4-3-5-13-12-8-9-19(2)15(6-7-17(19)21)14(12)10-16(20)18(11)13/h3-5,12,14-15H,6-10H2,1-2H3/t12-,14-,15+,19+/m1/s1
InChIKey IGEVSLBEVLLNTP-IBWPGLOJSA-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 282.382 g/mol
Solvent CDCl3
Source File Reference UNIW65