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5.alpha.-Androstan-16-one, 17.beta.-hydroxy-3.beta.-methoxy-
SpectraBase Compound ID 6sRNcxLq2WB
InChI InChI=1S/C20H32O3/c1-19-8-6-13(23-3)10-12(19)4-5-14-15(19)7-9-20(2)16(14)11-17(21)18(20)22/h12-16,18,22H,4-11H2,1-3H3/t12-,13-,14+,15-,16-,18-,19-,20-/m0/s1
InChIKey CJNPFAPLPPPINA-WVCYWSPPSA-N
Mol Weight 320.5 g/mol
Molecular Formula C20H32O3
Exact Mass 320.235145 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BT5TUnv1AgY
Name 5.alpha.-Androstan-16-one, 17.beta.-hydroxy-3.beta.-methoxy-
Alternate Name(s) Androstan-16-one, 17-hydroxy-3-methoxy-, (3.beta.,5.alpha.,17.beta.)- (3beta,5alpha,17beta)-17-hydroxy-3-methoxyandrostan-16-one 17.beta.-hydroxy-3.beta.-methoxy-5.alpha.-androstan-16-one
CAS Registry Number 110248-06-1
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H32O3
InChI InChI=1S/C20H32O3/c1-19-8-6-13(23-3)10-12(19)4-5-14-15(19)7-9-20(2)16(14)11-17(21)18(20)22/h12-16,18,22H,4-11H2,1-3H3/t12-,13-,14+,15-,16-,18-,19-,20-/m0/s1
InChIKey CJNPFAPLPPPINA-WVCYWSPPSA-N
Molecular Weight 320.473 g/mol
SMILES O[C@]1(C(=O)C[C@@]2([C@@]1(CC[C@@]1([C@@]3([C@@](C[C@](CC3)(OC)[H])([H])CC[C@@]21[H])C)[H])C)[H])[H]
SPLASH splash10-0udi-0094000000-a4e5d597ebc4d1871c70
Source of Spectrum KC-1990-1243-18
Wiley ID 1320454