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2-(3,5-dimethyl-4-isoxazolyl)-3-phenylpropanenitrile
SpectraBase Compound ID EYYGRvHlSYs
InChI InChI=1S/C14H14N2O/c1-10-14(11(2)17-16-10)13(9-15)8-12-6-4-3-5-7-12/h3-7,13H,8H2,1-2H3
InChIKey USTHRJODILPNRA-UHFFFAOYSA-N
Mol Weight 226.28 g/mol
Molecular Formula C14H14N2O
Exact Mass 226.110613 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID I01Z0m43QyI
Name 2-(3,5-dimethyl-4-isoxazolyl)-3-phenylpropanenitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14N2O
InChI InChI=1S/C14H14N2O/c1-10-14(11(2)17-16-10)13(9-15)8-12-6-4-3-5-7-12/h3-7,13H,8H2,1-2H3
InChIKey USTHRJODILPNRA-UHFFFAOYSA-N
Molecular Weight 226.279 g/mol
SMILES c1(C(C#N)Cc2ccccc2)c(onc1C)C
SPLASH splash10-0006-9000000000-e409f623d96e7bbe669d
Source of Spectrum Y4-83-190-7
Synonyms 2-(3,5-dimethyl-1,2-oxazol-4-yl)-3-phenylpropanenitrile 2-(3,5-dimethylisoxazol-4-yl)-3-phenyl-propanenitrile 2-(3,5-dimethyl-1,2-oxazol-4-yl)-3-phenyl-propanenitrile
Wiley ID 1549936