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27-Norcholesta-5,24-dien-3-ol, 25-(1,1-dimethylethyl)-, (3.beta.,24E)-
SpectraBase Compound ID HDKrsCijUr3
InChI InChI=1S/C30H50O/c1-20(9-8-10-21(2)28(3,4)5)25-13-14-26-24-12-11-22-19-23(31)15-17-29(22,6)27(24)16-18-30(25,26)7/h10-11,20,23-27,31H,8-9,12-19H2,1-7H3/b21-10+/t20-,23+,24+,25-,26+,27+,29+,30-/m1/s1
InChIKey BTLRYUSDPRAXGT-UCVYFYKISA-N
Mol Weight 426.7 g/mol
Molecular Formula C30H50O
Exact Mass 426.386166 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HZhkSV05gaZ
Name 27-Norcholesta-5,24-dien-3-ol, 25-(1,1-dimethylethyl)-, (3.beta.,24E)-
CAS Registry Number 119879-66-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C30H50O
InChI InChI=1S/C30H50O/c1-20(9-8-10-21(2)28(3,4)5)25-13-14-26-24-12-11-22-19-23(31)15-17-29(22,6)27(24)16-18-30(25,26)7/h10-11,20,23-27,31H,8-9,12-19H2,1-7H3/b21-10+/t20-,23+,24+,25-,26+,27+,29+,30-/m1/s1
InChIKey BTLRYUSDPRAXGT-UCVYFYKISA-N
Molecular Weight 426.729 g/mol
SMILES O[C@]1(CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC=C2C1)[H])(CC[C@@]4([C@@](CC\C=C\(C(C)(C)C)C)(C)[H])[H])[H])C)[H])C)[H]
SPLASH splash10-004i-3023900000-914f81e7c839791568a5
Source of Spectrum J-54-2124-67
Synonyms (1S,2R,5S,10S,11S,14R,15R)-2,15-dimethyl-14-[(2R,5E)-6,7,7-trimethyloct-5-en-2-yl]tetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-7-en-5-ol 25-(tert-butyl)-27-norcholesta-5,24(E)-dien-3.beta.-ol
Wiley ID 1380265