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Androst-5-en-17-one, 3-hydroxy-19-(propylthio)-, (3.beta.)-
SpectraBase Compound ID BM682qa2wTm
InChI InChI=1S/C22H34O2S/c1-3-12-25-14-22-11-8-16(23)13-15(22)4-5-17-18-6-7-20(24)21(18,2)10-9-19(17)22/h4,16-19,23H,3,5-14H2,1-2H3/t16-,17-,18-,19-,21-,22+/m0/s1
InChIKey UFFUQMUALPOISS-OVMLJTRSSA-N
Mol Weight 362.6 g/mol
Molecular Formula C22H34O2S
Exact Mass 362.227952 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KxU37zBLZrW
Name Androst-5-en-17-one, 3-hydroxy-19-(propylthio)-, (3.beta.)-
CAS Registry Number 125631-99-4
Comments Less than 3 mono-isotopic peaks
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Formula C22H34O2S
InChI InChI=1S/C22H34O2S/c1-3-12-25-14-22-11-8-16(23)13-15(22)4-5-17-18-6-7-20(24)21(18,2)10-9-19(17)22/h4,16-19,23H,3,5-14H2,1-2H3/t16-,17-,18-,19-,21-,22+/m0/s1
InChIKey UFFUQMUALPOISS-OVMLJTRSSA-N
Molecular Weight 362.572 g/mol
SMILES O[C@]1(CC[C@]2(C(=CC[C@]3([C@@]4(CCC([C@]4(CC[C@]23[H])C)=O)[H])[H])C1)CSCCC)[H]
SPLASH splash10-0a4i-0092000000-ebc5ecbd72c0cd2bf433
Source of Spectrum KC-1989-1651-9
Synonyms (3beta)-3-hydroxy-19-(propylsulfanyl)androst-5-en-17-one 3.beta.-hydroxy-19-propylthioandrost-5-en-17-one
Wiley ID 1349815