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17-ALPHA-ETHINYL-ESTR-4-ENE-3-BETA,17-DIOL-3-ACETATE-17-(3-OXO-BUTANOATE)
SpectraBase Compound ID 5zaLJXxGu60
InChI InChI=1S/C26H34O5/c1-5-26(31-24(29)14-16(2)27)13-11-23-22-8-6-18-15-19(30-17(3)28)7-9-20(18)21(22)10-12-25(23,26)4/h1,15,19-23H,6-14H2,2-4H3/t19-,20-,21+,22+,23-,25-,26-/m0/s1
InChIKey GRTLYENPPNIPCW-VVTGHDNKSA-N
Mol Weight 426.6 g/mol
Molecular Formula C26H34O5
Exact Mass 426.240624 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LcHfrwgGVrc
Name 17-ALPHA-ETHINYL-ESTR-4-ENE-3-BETA,17-DIOL-3-ACETATE-17-(3-OXO-BUTANOATE)
Compound Number 11
Copyright Copyright © 2016-2025 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C26H34O5
InChI InChI=1S/C26H34O5/c1-5-26(31-24(29)14-16(2)27)13-11-23-22-8-6-18-15-19(30-17(3)28)7-9-20(18)21(22)10-12-25(23,26)4/h1,15,19-23H,6-14H2,2-4H3/t19-,20-,21+,22+,23-,25-,26-/m0/s1
InChIKey GRTLYENPPNIPCW-VVTGHDNKSA-N
Literature Reference Author M.BABJAK,G.BALOGH,M.GAZDAG,S.GOEROEG
Literature Reference Citation J.PHARM.BIOM.ANAL.,29,1153(2002)
Literature Reference DOI 10.1016/s0731-7085(02)00165-6
Molecular Weight 426.553 g/mol
Solvent CDCl3
Source File Reference UWMZ45112