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17.beta.-Acetoxy-4,5.alpha.-epoxyandrostane
SpectraBase Compound ID 6Ab6cMy4Fcx
InChI InChI=1S/C21H32O3/c1-13(22)23-17-7-6-15-14-8-12-21-18(24-21)5-4-10-20(21,3)16(14)9-11-19(15,17)2/h14-18H,4-12H2,1-3H3/t14-,15-,16-,17-,18?,19-,20+,21+/m0/s1
InChIKey KCNFNMNXNSDYER-TUXYUONUSA-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 8TvT1OhROSt
Name 17.beta.-Acetoxy-4,5.alpha.-epoxyandrostane
Comments Less than 3 mono-isotopic peaks
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Formula C21H32O3
InChI InChI=1S/C21H32O3/c1-13(22)23-17-7-6-15-14-8-12-21-18(24-21)5-4-10-20(21,3)16(14)9-11-19(15,17)2/h14-18H,4-12H2,1-3H3/t14-,15-,16-,17-,18?,19-,20+,21+/m0/s1
InChIKey KCNFNMNXNSDYER-TUXYUONUSA-N
Molecular Weight 332.484 g/mol
SMILES C1CC[C@]2([C@]3(C1O3)CC[C@]1([C@@]3(CC[C@@]([C@@]3(C)CC[C@]21[H])(OC(=O)C)[H])[H])[H])C
SPLASH splash10-00di-0009000000-7c52e8107af2614d4ee7
Source of Spectrum K1-2004-4786-1
Synonyms (4aR,4bS,6aS,7S,9aS,9bS,11aS)-4a,6a-dimethylhexadecahydrocyclopenta[7,8]phenanthro[1,10a-b]oxiren-7-yl acetate
Wiley ID 1559976