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5.alpha.-androstan-15-one-14.alpha.,16,16-D3
SpectraBase Compound ID H8ZZmpesSzt
InChI InChI=1S/C19H30O/c1-18-11-8-15-14(17(18)16(20)9-12-18)7-6-13-5-3-4-10-19(13,15)2/h13-15,17H,3-12H2,1-2H3/t13-,14-,15+,17-,18-,19+/m1/s1/i9D2,17D
InChIKey GFIHCUMZMSPMBT-MMIVRNDOSA-N
Mol Weight 277.47 g/mol
Molecular Formula C19H272D3O
Exact Mass 277.248496 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IBocpenmzaU
Name 5.alpha.-androstan-15-one-14.alpha.,16,16-D3
CAS Registry Number 741-23-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H27D3O
InChI InChI=1S/C19H30O/c1-18-11-8-15-14(17(18)16(20)9-12-18)7-6-13-5-3-4-10-19(13,15)2/h13-15,17H,3-12H2,1-2H3/t13-,14-,15+,17-,18-,19+/m1/s1/i9D2,17D
InChIKey GFIHCUMZMSPMBT-MMIVRNDOSA-N
Molecular Weight 277.466 g/mol
SMILES [C@]12([C@@]([C@@]3(C)CCCC[C@@]3(CC2)[H])(CC[C@]2([C@]1(C(C([2D])([2D])C2)=O)[2D])C)[H])[H]
SPLASH splash10-0zir-4930000000-11b1bfb817be198609b3
Source of Spectrum C-87-821-4
Wiley ID 1278668