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Acetamide, N-[(5.alpha.,17.alpha.)-18-iodoandrostan-17-yl]-
SpectraBase Compound ID GhI7wCMqems
InChI InChI=1S/C21H34INO/c1-14(24)23-19-9-8-18-16-7-6-15-5-3-4-11-20(15,2)17(16)10-12-21(18,19)13-22/h15-19H,3-13H2,1-2H3,(H,23,24)/t15-,16-,17+,18+,19-,20+,21-/m1/s1
InChIKey MYXLTVJVJDDGAJ-TWKNJJFGSA-N
Mol Weight 443.4 g/mol
Molecular Formula C21H34INO
Exact Mass 443.16851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7O5ssVZlZwm
Name Acetamide, N-[(5.alpha.,17.alpha.)-18-iodoandrostan-17-yl]-
Alternate Name(s) Androstane, acetamide deriv. 18-iodo-17 .alpha.-acetamido-5 .alpha.-androstane N-[(5alpha,17alpha)-18-iodoandrostan-17-yl]acetamide
CAS Registry Number 69063-96-3
Comments Less than 3 mono-isotopic peaks
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Formula C21H34INO
InChI InChI=1S/C21H34INO/c1-14(24)23-19-9-8-18-16-7-6-15-5-3-4-11-20(15,2)17(16)10-12-21(18,19)13-22/h15-19H,3-13H2,1-2H3,(H,23,24)/t15-,16-,17+,18+,19-,20+,21-/m1/s1
InChIKey MYXLTVJVJDDGAJ-TWKNJJFGSA-N
Molecular Weight 443.413 g/mol
SMILES N([C@]1([C@@]2([C@]([C@@]3(CC[C@@]4([C@]([C@]3(CC2)[H])(C)CCCC4)[H])[H])(CC1)[H])CI)[H])C(=O)C
SPLASH splash10-0a4i-0093000000-dff056e6ae0a964c73cb
Source of Spectrum F-34-1535-0
Wiley ID 1385696