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4-(4,4-Dimethyloxazolinyl)benzonitrile

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4-(4,4-Dimethyloxazolinyl)benzonitrile
SpectraBase Compound ID V2oexX7ph
InChI InChI=1S/C12H12N2O/c1-12(2)8-15-11(14-12)10-5-3-9(7-13)4-6-10/h3-6H,8H2,1-2H3
InChIKey PLXIVNIDAFUXCT-UHFFFAOYSA-N
Mol Weight 200.24 g/mol
Molecular Formula C12H12N2O
Exact Mass 200.094963 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9L80CWtDR7U
Name 4-(4,4-Dimethyloxazolinyl)benzonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H12N2O
InChI InChI=1S/C12H12N2O/c1-12(2)8-15-11(14-12)10-5-3-9(7-13)4-6-10/h3-6H,8H2,1-2H3
InChIKey PLXIVNIDAFUXCT-UHFFFAOYSA-N
Literature Reference DOI 10.1039/c5cc01144b
Molecular Weight 200.241 g/mol
SMILES c1cc(ccc1C#N)C1=NC(CO1)(C)C
SPLASH splash10-002r-3900000000-58d1c032eadca06cd343
Source of Spectrum KD-51-6415/SMSI6-5c
Synonyms 4-(4,4-dimethyl-4,5-dihydrooxazol-2-yl)benzonitrile 4-(4,4-dimethyl-5H-1,3-oxazol-2-yl)benzonitrile 4-(4,4-dimethyl-5H-oxazol-2-yl)benzonitrile 4-(4,4-dimethyl-5H-1,3-oxazol-2-yl)benzenecarbonitrile
Wiley ID 1760581