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11,11,16,16-D4-5a-pregnan-3b-ol
SpectraBase Compound ID 6Y9n1IWe4t9
InChI InChI=1S/C21H36O/c1-4-14-6-8-18-17-7-5-15-13-16(22)9-11-21(15,3)19(17)10-12-20(14,18)2/h14-19,22H,4-13H2,1-3H3/t14-,15?,16-,17-,18-,19-,20+,21+/m0/s1/i6D2,10D2
InChIKey CEBZORSAHLSRQW-KVBPVMOXSA-N
Mol Weight 308.5 g/mol
Molecular Formula C21H322D4O
Exact Mass 308.301723 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BrcIZCOfshs
Name 11,11,16,16-D4-5a-pregnan-3b-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H32D4O
InChI InChI=1S/C21H36O/c1-4-14-6-8-18-17-7-5-15-13-16(22)9-11-21(15,3)19(17)10-12-20(14,18)2/h14-19,22H,4-13H2,1-3H3/t14-,15?,16-,17-,18-,19-,20+,21+/m0/s1/i6D2,10D2
InChIKey CEBZORSAHLSRQW-KVBPVMOXSA-N
Molecular Weight 308.542 g/mol
SMILES O[C@]1(CC[C@]2([C@@]3([C@@]([C@@]4(CC([2D])([2D])[C@@]([C@]4(CC3([2D])[2D])C)(CC)[H])[H])([H])CCC2C1)[H])C)[H]
SPLASH splash10-0a4r-7973000000-57f84411f241e8455c70
Source of Spectrum SD-1992-0-0
Wiley ID 1307049