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5-(2-Sulfanylbenzoyl)-2-methyl-4-(trifluoromethyl)pyrimidine

View entire compound with spectra: 1 MS (GC)

5-(2-Sulfanylbenzoyl)-2-methyl-4-(trifluoromethyl)pyrimidine
SpectraBase Compound ID YnEqe5fe3v
InChI InChI=1S/C13H9F3N2OS/c1-7-17-6-9(12(18-7)13(14,15)16)11(19)8-4-2-3-5-10(8)20/h2-6,20H,1H3
InChIKey AVSIBKAOQINPKN-UHFFFAOYSA-N
Mol Weight 298.28 g/mol
Molecular Formula C13H9F3N2OS
Exact Mass 298.038769 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Jijm3B5ttHl
Name 5-(2-Sulfanylbenzoyl)-2-methyl-4-(trifluoromethyl)pyrimidine
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9F3N2OS
InChI InChI=1S/C13H9F3N2OS/c1-7-17-6-9(12(18-7)13(14,15)16)11(19)8-4-2-3-5-10(8)20/h2-6,20H,1H3
InChIKey AVSIBKAOQINPKN-UHFFFAOYSA-N
Molecular Weight 298.283 g/mol
SMILES Sc1c(C(c2c(C(F)(F)F)nc(nc2)C)=O)cccc1
SPLASH splash10-002u-0940000000-683ad58731336c9bc949
Source of Spectrum F4-41-3238-8b
Wiley ID 1672828