John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=HECRDnj1aoh SpectraBase Spectrum ID=2v3kseuHu4n

(accessed ).
(+/-)-7(8->11)-ABEO-ESTRA-1,3,5(10),9(11)-TETRAENE-3,17-BETA-DIOL
SpectraBase Compound ID HECRDnj1aoh
InChI InChI=1S/C18H22O2/c1-18-10-12-3-2-11-8-14(19)5-6-15(11)16(12)9-13(18)4-7-17(18)20/h5-6,8,13,17,19-20H,2-4,7,9-10H2,1H3/t13-,17-,18-/m0/s1
InChIKey RKLMDGGTFYWSCU-KKXDTOCCSA-N
Mol Weight 270.37 g/mol
Molecular Formula C18H22O2
Exact Mass 270.16198 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2v3kseuHu4n
Name (+/-)-7(8->11)-ABEO-ESTRA-1,3,5(10),9(11)-TETRAENE-3,17-BETA-DIOL
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C18H22O2
InChI InChI=1S/C18H22O2/c1-18-10-12-3-2-11-8-14(19)5-6-15(11)16(12)9-13(18)4-7-17(18)20/h5-6,8,13,17,19-20H,2-4,7,9-10H2,1H3/t13-,17-,18-/m0/s1
InChIKey RKLMDGGTFYWSCU-KKXDTOCCSA-N
Literature Reference Author D.J.COLLINS,G.D.FALLON,C.E.SKENE
Literature Reference Citation AUSTR.J.CHEM.,45,71(1992)
Literature Reference DOI 10.1071/ch9920071
Molecular Weight 270.371 g/mol
Solvent CDCl3
Source File Reference UWRK50
SpectraBase Batch ID BzFKQhYx6Ko