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Pyrimidinium, 5-carboxy-2,4,6-trimethyl-1-phenyl-, hydroxide, inner salt
SpectraBase Compound ID GllgEiP2QYE
InChI InChI=1S/C14H14N2O2/c1-9-13(14(17)18)10(2)16(11(3)15-9)12-7-5-4-6-8-12/h4-8H,1-3H3
InChIKey UIGCQCCHDDRUGC-UHFFFAOYSA-N
Mol Weight 242.28 g/mol
Molecular Formula C14H14N2O2
Exact Mass 242.105528 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FjeQ0l8O226
Name Pyrimidinium, 5-carboxy-2,4,6-trimethyl-1-phenyl-, hydroxide, inner salt
Alternate Name(s) 1-Phenyl-2,4,6-trimethylpyrimidinium-5-carboxylate 2,4,6-trimethyl-1-phenylpyrimidin-1-ium-5-carboxylate
CAS Registry Number 108169-02-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O2
InChI InChI=1S/C14H14N2O2/c1-9-13(14(17)18)10(2)16(11(3)15-9)12-7-5-4-6-8-12/h4-8H,1-3H3
InChIKey UIGCQCCHDDRUGC-UHFFFAOYSA-N
Molecular Weight 242.278 g/mol
SMILES c1([n+](c(nc(c1C([O-])=O)C)C)-c1ccccc1)C
SPLASH splash10-0007-9500000000-0ad288012e4ed61ed46d
Source of Spectrum J-52-2464-3
Wiley ID 1245122