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(8S,20S)-Des-A,B-20-pentyl-pregnan-8-ol
SpectraBase Compound ID FoN9VykJdM4
InChI InChI=1S/C17H32O/c1-4-5-6-8-13(2)14-10-11-15-16(18)9-7-12-17(14,15)3/h13-16,18H,4-12H2,1-3H3/t13-,14+,15-,16-,17+/m0/s1
InChIKey HQKVTEVFMMHXMY-BQJWPVKWSA-N
Mol Weight 252.4 g/mol
Molecular Formula C17H32O
Exact Mass 252.245316 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4ZYuiStLYJP
Name (8S,20S)-Des-A,B-20-pentyl-pregnan-8-ol
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H32O
InChI InChI=1S/C17H32O/c1-4-5-6-8-13(2)14-10-11-15-16(18)9-7-12-17(14,15)3/h13-16,18H,4-12H2,1-3H3/t13-,14+,15-,16-,17+/m0/s1
InChIKey HQKVTEVFMMHXMY-BQJWPVKWSA-N
Ionization Type EI
Molecular Weight 252.442 g/mol
Optical Rotation [a]D = +10.5 (c = 1.4, CHC13)
SMILES O[C@]1(CCC[C@]2([C@]1(CC[C@@]2([C@](CCCCC)(C)[H])[H])[H])C)[H]
SPLASH splash10-03g0-1930000000-34fd8854f77d17d6fb9b
Source of Spectrum CA2781889A1
Wiley ID 1861469