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4-keto-6-(o-tolyl)-2-propoxy-1H-pyrimidine-5-carbonitrile
SpectraBase Compound ID 8GHF2Cwn2xN
InChI InChI=1S/C15H15N3O2/c1-3-8-20-15-17-13(12(9-16)14(19)18-15)11-7-5-4-6-10(11)2/h4-7H,3,8H2,1-2H3,(H,17,18,19)
InChIKey PKUBFKQFCVOGSZ-UHFFFAOYSA-N
Mol Weight 269.3 g/mol
Molecular Formula C15H15N3O2
Exact Mass 269.116427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AX27xBHYcC2
Name 4-keto-6-(o-tolyl)-2-propoxy-1H-pyrimidine-5-carbonitrile
CAS Registry Number 81960-76-1
Comments Less than 3 mono-isotopic peaks
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Formula C15H15N3O2
InChI InChI=1S/C15H15N3O2/c1-3-8-20-15-17-13(12(9-16)14(19)18-15)11-7-5-4-6-10(11)2/h4-7H,3,8H2,1-2H3,(H,17,18,19)
InChIKey PKUBFKQFCVOGSZ-UHFFFAOYSA-N
Molecular Weight 269.304 g/mol
SMILES N1C(C(=C(N=C1OCCC)c1c(C)cccc1)C#N)=O
SPLASH splash10-00or-0090000000-56777c1fd6371766fe09
Source of Spectrum Y-19-179-0
Synonyms 6-(2-methylphenyl)-4-oxidanylidene-2-propoxy-1H-pyrimidine-5-carbonitrile 6-(2-methylphenyl)-4-oxo-2-propoxy-1H-pyrimidine-5-carbonitrile 6-(o-tolyl)-4-oxo-2-propoxy-1H-pyrimidine-5-carbonitrile
Wiley ID 1273210