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Androst-5-ene-17-carbonitrile, 4-acetoxy-17-hydroxy-
SpectraBase Compound ID 8mgzLln2UNc
InChI InChI=1S/C22H31NO3/c1-14(24)26-19-5-4-10-20(2)16-8-11-21(3)17(9-12-22(21,25)13-23)15(16)6-7-18(19)20/h7,15-17,19,25H,4-6,8-12H2,1-3H3/t15?,16?,17?,19?,20-,21+,22+/m1/s1
InChIKey SUEQIKGGHZVRFU-VFFLQBSQSA-N
Mol Weight 357.49 g/mol
Molecular Formula C22H31NO3
Exact Mass 357.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K7nZOAbUKVK
Name Androst-5-ene-17-carbonitrile, 4-acetoxy-17-hydroxy-
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H31NO3
InChI InChI=1S/C22H31NO3/c1-14(24)26-19-5-4-10-20(2)16-8-11-21(3)17(9-12-22(21,25)13-23)15(16)6-7-18(19)20/h7,15-17,19,25H,4-6,8-12H2,1-3H3/t15?,16?,17?,19?,20-,21+,22+/m1/s1
InChIKey SUEQIKGGHZVRFU-VFFLQBSQSA-N
Molecular Weight 357.494 g/mol
SMILES O[C@]1([C@]2(CCC3[C@@]4(C(=CCC3C2CC1)C(OC(=O)C)CCC4)C)C)C#N
SPLASH splash10-006x-9730000000-c41ca1e37e18599d46dc
Source of Spectrum AD-0-2532-0
Synonyms 17-Cyano-17-hydroxyandrost-5-en-4-yl acetate
Wiley ID 1420363