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4-METHYLESTRA-1,3,5(10)-TRIEN

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4-METHYLESTRA-1,3,5(10)-TRIEN
SpectraBase Compound ID 3qGJKvc8PXB
InChI InChI=1S/C19H26/c1-13-5-3-6-15-14(13)8-9-17-16(15)10-12-19(2)11-4-7-18(17)19/h3,5-6,16-18H,4,7-12H2,1-2H3/t16-,17-,18+,19+/m1/s1
InChIKey FJPJFWVQWDREPZ-YRXWBPOGSA-N
Mol Weight 254.42 g/mol
Molecular Formula C19H26
Exact Mass 254.203451 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2GyjLI7uhZe
Name 4-METHYLESTRA-1,3,5(10)-TRIEN
Compound Number 409
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C19H26
InChI InChI=1S/C19H26/c1-13-5-3-6-15-14(13)8-9-17-16(15)10-12-19(2)11-4-7-18(17)19/h3,5-6,16-18H,4,7-12H2,1-2H3/t16-,17-,18+,19+/m1/s1
InChIKey FJPJFWVQWDREPZ-YRXWBPOGSA-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 254.415 g/mol
Solvent CDCl3
Source File Reference UNIW69