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Benzoic acid <2-benzoyl->, mono-TMS
SpectraBase Compound ID 4508KxteElW
InChI InChI=1S/C17H18O3Si/c1-21(2,3)20-17(19)15-12-8-7-11-14(15)16(18)13-9-5-4-6-10-13/h4-12H,1-3H3
InChIKey KSLHDRXHSXBYCN-UHFFFAOYSA-N
Mol Weight 298.41 g/mol
Molecular Formula C17H18O3Si
Exact Mass 298.102521 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 437WzYLFA0
Name Benzoic acid <2-benzoyl->, mono-TMS
CAS Registry Number 87061-51-6
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 298.102520972 u
Formula C17H18O3Si
GC Column HP-5ms (30 m × 0.25 mm ID x 0.25 μm film thickness)
InChI InChI=1S/C17H18O3Si/c1-21(2,3)20-17(19)15-12-8-7-11-14(15)16(18)13-9-5-4-6-10-13/h4-12H,1-3H3
InChIKey KSLHDRXHSXBYCN-UHFFFAOYSA-N
Molecular Weight 298.413 g/mol
Nominal Mass 298 u
Number of Peaks 247
SMILES c1c(cccc1)C(c1c(cccc1)C(O[Si](C)(C)C)=O)=O
SPLASH splash10-053r-2390000000-ea4bd938eff5457f470d
Source TriMen Chemicals
Source of Spectrum Biologically and Environmentally Important Organic Compounds: GCMS Library
Synonyms 2-Benzoylbenzoic acid, mono-TMS
Wiley ID VI001559