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Androst-4-ene-3,17-dione, 6-chloro-11-hydroxy-, (6.beta.,11.alpha.)-
SpectraBase Compound ID 6wNHezm92Gi
InChI InChI=1S/C19H25ClO3/c1-18-6-5-10(21)7-13(18)14(20)8-11-12-3-4-16(23)19(12,2)9-15(22)17(11)18/h7,11-12,14-15,17,22H,3-6,8-9H2,1-2H3/t11-,12-,14+,15+,17+,18-,19-/m0/s1
InChIKey ZNNMBRUDHQLRCI-YPIFDJLOSA-N
Mol Weight 336.86 g/mol
Molecular Formula C19H25ClO3
Exact Mass 336.149222 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6PpdvbUVIqV
Name Androst-4-ene-3,17-dione, 6-chloro-11-hydroxy-, (6.beta.,11.alpha.)-
Alternate Name(s) (6beta,11alpha)-6-chloro-11-hydroxyandrost-4-ene-3,17-dione 6.beta.-chloro-11.alpha.-hydroxyandrost-4-ene-3,17-dione
CAS Registry Number 71418-20-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H25ClO3
InChI InChI=1S/C19H25ClO3/c1-18-6-5-10(21)7-13(18)14(20)8-11-12-3-4-16(23)19(12,2)9-15(22)17(11)18/h7,11-12,14-15,17,22H,3-6,8-9H2,1-2H3/t11-,12-,14+,15+,17+,18-,19-/m0/s1
InChIKey ZNNMBRUDHQLRCI-YPIFDJLOSA-N
Molecular Weight 336.859 g/mol
SMILES O[C@]1([C@@]2([C@@]3(C([C@](Cl)(C[C@]2([C@@]2(CCC([C@]2(C1)C)=O)[H])[H])[H])=CC(CC3)=O)C)[H])[H]
SPLASH splash10-0udi-0049000000-92ba6809f9e9ded7bc95
Source of Spectrum I-57-1587-0
Wiley ID 1332403