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2-(2,6-dimethylanilino)-5-methyl-1,3-oxazole-4-carbonitrile
SpectraBase Compound ID 4bmSwSPIDjt
InChI InChI=1S/C13H13N3O/c1-8-5-4-6-9(2)12(8)16-13-15-11(7-14)10(3)17-13/h4-6H,1-3H3,(H,15,16)
InChIKey JCHCRCITMCBUTO-UHFFFAOYSA-N
Mol Weight 227.27 g/mol
Molecular Formula C13H13N3O
Exact Mass 227.105862 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6KII4x2Mvp2
Name 2-(2,6-dimethylanilino)-5-methyl-1,3-oxazole-4-carbonitrile
CAS Registry Number 122686-36-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H13N3O
InChI InChI=1S/C13H13N3O/c1-8-5-4-6-9(2)12(8)16-13-15-11(7-14)10(3)17-13/h4-6H,1-3H3,(H,15,16)
InChIKey JCHCRCITMCBUTO-UHFFFAOYSA-N
Molecular Weight 227.267 g/mol
SMILES N(c1nc(C#N)c(o1)C)c1c(cccc1C)C
SPLASH splash10-001i-1920000000-a7725459493225315b7f
Source of Spectrum H-72-567-6
Synonyms 2-(2,6-dimethylanilino)-5-methyl-4-oxazolecarbonitrile 2-[(2,6-dimethylphenyl)amino]-5-methyl-1,3-oxazole-4-carbonitrile
Wiley ID 1228640