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17,19-di(chloroacetoxy)-3.beta.-hydroxyandrost-5-ene
SpectraBase Compound ID 5wNywzwdywe
InChI InChI=1S/C23H32Cl2O5/c1-22-8-7-18-16(17(22)4-5-19(22)30-21(28)12-25)3-2-14-10-15(26)6-9-23(14,18)13-29-20(27)11-24/h2,15-19,26H,3-13H2,1H3/t15-,16-,17-,18-,19?,22-,23+/m0/s1
InChIKey JMKFOMFVIKMQFB-MDRUKAQRSA-N
Mol Weight 459.4 g/mol
Molecular Formula C23H32Cl2O5
Exact Mass 458.16268 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7a3hYvubvvD
Name 17,19-di(chloroacetoxy)-3.beta.-hydroxyandrost-5-ene
Alternate Name(s) (3beta)-17-[(chloroacetyl)oxy]-3-hydroxyandrost-5-en-19-yl chloroacetate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H32Cl2O5
InChI InChI=1S/C23H32Cl2O5/c1-22-8-7-18-16(17(22)4-5-19(22)30-21(28)12-25)3-2-14-10-15(26)6-9-23(14,18)13-29-20(27)11-24/h2,15-19,26H,3-13H2,1H3/t15-,16-,17-,18-,19?,22-,23+/m0/s1
InChIKey JMKFOMFVIKMQFB-MDRUKAQRSA-N
Molecular Weight 459.410 g/mol
SMILES O[C@]1(CC[C@]2(C(=CC[C@]3([C@@]4(CCC([C@]4(CC[C@]23[H])C)OC(=O)CCl)[H])[H])C1)COC(=O)CCl)[H]
SPLASH splash10-0021-0079000000-be51441eaf9dfb306f62
Source of Spectrum JC-440-419-5
Wiley ID 1389819