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Androst-16-en-3-one, 11-hydroxy-, cyclic 1,2-ethanediyl acetal, (5.alpha.,11.alpha.)-
SpectraBase Compound ID aTOebDnQDX
InChI InChI=1S/C21H32O3/c1-19-7-3-4-16(19)15-6-5-14-12-21(23-10-11-24-21)9-8-20(14,2)18(15)17(22)13-19/h3,7,14-18,22H,4-6,8-13H2,1-2H3/t14?,15-,16-,17?,18+,19-,20-/m0/s1
InChIKey OZORPYGCZUNLNY-YQJZSWFGSA-N
Mol Weight 332.5 g/mol
Molecular Formula C21H32O3
Exact Mass 332.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5GW4bqMcBD
Name Androst-16-en-3-one, 11-hydroxy-, cyclic 1,2-ethanediyl acetal, (5.alpha.,11.alpha.)-
CAS Registry Number 113278-77-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32O3
InChI InChI=1S/C21H32O3/c1-19-7-3-4-16(19)15-6-5-14-12-21(23-10-11-24-21)9-8-20(14,2)18(15)17(22)13-19/h3,7,14-18,22H,4-6,8-13H2,1-2H3/t14?,15-,16-,17?,18+,19-,20-/m0/s1
InChIKey OZORPYGCZUNLNY-YQJZSWFGSA-N
Molecular Weight 332.484 g/mol
SMILES OC1[C@@]2([C@@]3(C(CC4(CC3)OCCO4)CC[C@]2([C@@]2(CC=C[C@]2(C1)C)[H])[H])C)[H]
SPLASH splash10-0002-9200000000-61cecc9dc445f501abff
Source of Spectrum KC-1988-1656-11
Synonyms Spiro[3H-cyclopenta[a]phenanthrene-3,2'-[1,3]dioxolane], androst-16-ene-3,11-dione deriv. (1'S,2'S,10'S,11'S,15'R)-2',15'-dimethylspiro[1,3-dioxolane-2,5'-tetracyclo[8.7.0.0(2,7).0(11,15)]heptadecan]-13'-en-17'-ol 3,3'-Ethylenedioxy-5.alpha.-androst-16-en-11.alpha.-ol
Wiley ID 1329802