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(3.beta.,17.alpha.)-19-norpregnan-4-en-20-yne-3,17-diacetoxy
SpectraBase Compound ID 8KZ2HFqQINe
InChI InChI=1S/C24H32O4/c1-5-24(28-16(3)26)13-11-22-21-8-6-17-14-18(27-15(2)25)7-9-19(17)20(21)10-12-23(22,24)4/h1,14,18-22H,6-13H2,2-4H3/t18-,19?,20+,21+,22-,23-,24+/m0/s1
InChIKey ONKUMRGIYFNPJW-SXJTXPQDSA-N
Mol Weight 384.5 g/mol
Molecular Formula C24H32O4
Exact Mass 384.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JErtKQdVqrZ
Name (3.beta.,17.alpha.)-19-norpregnan-4-en-20-yne-3,17-diacetoxy
Alternate Name(s) (3beta,17alpha)-17-(acetyloxy)-17-ethynylestr-4-en-3-yl acetate Ethynodiol-diacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H32O4
InChI InChI=1S/C24H32O4/c1-5-24(28-16(3)26)13-11-22-21-8-6-17-14-18(27-15(2)25)7-9-19(17)20(21)10-12-23(22,24)4/h1,14,18-22H,6-13H2,2-4H3/t18-,19?,20+,21+,22-,23-,24+/m0/s1
InChIKey ONKUMRGIYFNPJW-SXJTXPQDSA-N
Molecular Weight 384.516 g/mol
SMILES [C@@]12([C@](C#C)(OC(=O)C)CC[C@]2([C@@]2(CCC=3C([C@]2(CC1)[H])CC[C@](OC(=O)C)(C3)[H])[H])[H])C
SPLASH splash10-00yl-3619000000-8f347e1a6f55df457034
Source of Spectrum CJ-0-54-0
Wiley ID 1361815