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Cholesterol <7-dehydro->, mono-TMS
SpectraBase Compound ID J11Ojo64d2s
InChI InChI=1S/C30H52OSi/c1-21(2)10-9-11-22(3)26-14-15-27-25-13-12-23-20-24(31-32(6,7)8)16-18-29(23,4)28(25)17-19-30(26,27)5/h12-13,21-22,24,26-28H,9-11,14-20H2,1-8H3/t22?,24-,26+,27-,28-,29-,30+/m0/s1
InChIKey MMOYFYVZAFLUGC-FGCCFFDOSA-N
Mol Weight 456.8 g/mol
Molecular Formula C30H52OSi
Exact Mass 456.378743 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9dCD28o2muE
Name Cholesterol <7-dehydro->, mono-TMS
CAS Registry Number 2625-44-7
Copyright Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 456.378742828 u
Formula C30H52OSi
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C30H52OSi/c1-21(2)10-9-11-22(3)26-14-15-27-25-13-12-23-20-24(31-32(6,7)8)16-18-29(23,4)28(25)17-19-30(26,27)5/h12-13,21-22,24,26-28H,9-11,14-20H2,1-8H3/t22?,24-,26+,27-,28-,29-,30+/m0/s1
InChIKey MMOYFYVZAFLUGC-FGCCFFDOSA-N
Molecular Weight 456.830 g/mol
Nominal Mass 456 u
Number of Peaks 431
SMILES [C@]1(O[Si](C)(C)C)(CC=2[C@@]([C@@]3(C([C@]4([C@@]([C@](CC4)(C(CCCC(C)C)C)[H])(CC3)C)[H])=CC2)[H])(CC1)C)[H]
SPLASH splash10-0ufr-4925000000-0002fa2db5c44a08f501
Source Cayman Chemical
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Synonyms 7-Hydroxycholesterol, mono-TMS
Wiley ID VI001817