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Trimethylsilyl 3-[(trimethylsilyl)oxy]cholan-24-oate
SpectraBase Compound ID 1CaxWfhcCy2
InChI InChI=1S/C30H56O3Si2/c1-21(10-15-28(31)33-35(7,8)9)25-13-14-26-24-12-11-22-20-23(32-34(4,5)6)16-18-29(22,2)27(24)17-19-30(25,26)3/h21-27H,10-20H2,1-9H3
InChIKey PZEKZBLVDCPZQL-UHFFFAOYSA-N
Mol Weight 520.9 g/mol
Molecular Formula C30H56O3Si2
Exact Mass 520.376799 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D82bq8krann
Name Litocholic acid, di-TMS
Copyright Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved.
Exact Mass 520.376798730 u
Formula C30H56O3Si2
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C30H56O3Si2/c1-21(10-15-28(31)33-35(7,8)9)25-13-14-26-24-12-11-22-20-23(32-34(4,5)6)16-18-29(22,2)27(24)17-19-30(25,26)3/h21-27H,10-20H2,1-9H3
InChIKey PZEKZBLVDCPZQL-UHFFFAOYSA-N
Molecular Weight 520.945 g/mol
Nominal Mass 520 u
Number of Peaks 425
SMILES C(C1C2(C)C(C3C(CC2)C2(C)C(CC3)CC(CC2)O[Si](C)(C)C)CC1)(C)CCC(O[Si](C)(C)C)=O
SPLASH splash10-0690-5971200000-a2156a0e5a2fb7f78539
Source Sigma
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Wiley ID VI000666