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(20S)-de-A,B-25-methylcholestan-8.beta.-ol
SpectraBase Compound ID 9PBn9UU1hvi
InChI InChI=1S/C19H36O/c1-14(8-6-12-18(2,3)4)15-10-11-16-17(20)9-7-13-19(15,16)5/h14-17,20H,6-13H2,1-5H3/t14-,15+,16-,17-,19+/m0/s1
InChIKey AEAIATBWUMIAEW-CNMWIUBYSA-N
Mol Weight 280.5 g/mol
Molecular Formula C19H36O
Exact Mass 280.276616 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LBEGsMGtg8I
Name (20S)-de-A,B-25-methylcholestan-8.beta.-ol
Appearance Colorless oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H36O
InChI InChI=1S/C19H36O/c1-14(8-6-12-18(2,3)4)15-10-11-16-17(20)9-7-13-19(15,16)5/h14-17,20H,6-13H2,1-5H3/t14-,15+,16-,17-,19+/m0/s1
InChIKey AEAIATBWUMIAEW-CNMWIUBYSA-N
Ionization Type EI
Molecular Weight 280.496 g/mol
Optical Rotation [a]D = +8.2 (c = 1.15, CHCl3)
SMILES O[C@]1(CCC[C@]2([C@]1(CC[C@@]2([C@](CCCC(C)(C)C)(C)[H])[H])[H])C)[H]
SPLASH splash10-03ea-3930000000-247e14da40101a878deb
Source of Spectrum AU2004260642B2
Wiley ID 1870273