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Pyrimidinium, 5-carboxy-4-(1,1-dimethylethyl)-1,2,6-trimethyl-, hydroxide, inner salt
SpectraBase Compound ID 69Mn9L0dK8E
InChI InChI=1S/C12H18N2O2/c1-7-9(11(15)16)10(12(3,4)5)13-8(2)14(7)6/h1-6H3
InChIKey OKLOPPQYIGPYIH-UHFFFAOYSA-N
Mol Weight 222.29 g/mol
Molecular Formula C12H18N2O2
Exact Mass 222.136828 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FYjztbDrqfV
Name Pyrimidinium, 5-carboxy-4-(1,1-dimethylethyl)-1,2,6-trimethyl-, hydroxide, inner salt
Alternate Name(s) 4-tert-Butyl-1,2,6-trimethylpyrimidin-1-ium-5-carboxylate 4-tert-Butyl-1,2,6-trimethylpyrimidinium-5-carboxylate
CAS Registry Number 108169-05-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H18N2O2
InChI InChI=1S/C12H18N2O2/c1-7-9(11(15)16)10(12(3,4)5)13-8(2)14(7)6/h1-6H3
InChIKey OKLOPPQYIGPYIH-UHFFFAOYSA-N
Molecular Weight 222.288 g/mol
SMILES c1([n+](c(nc(c1C([O-])=O)C(C)(C)C)C)C)C
SPLASH splash10-072c-5900000000-41aba101845d6ed36d7a
Source of Spectrum J-52-2465-3
Wiley ID 1222372