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3-(4-Methoxyphenyl)-2,1-benzoxazole-5,6-dicarbonitrile
SpectraBase Compound ID JgRkqw6jdwV
InChI InChI=1S/C16H9N3O2/c1-20-13-4-2-10(3-5-13)16-14-6-11(8-17)12(9-18)7-15(14)19-21-16/h2-7H,1H3
InChIKey UPJKUAUCTYOGDH-UHFFFAOYSA-N
Mol Weight 275.27 g/mol
Molecular Formula C16H9N3O2
Exact Mass 275.069477 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Cleh7ccdWth
Name 3-(4-Methoxyphenyl)-2,1-benzoxazole-5,6-dicarbonitrile
Alternate Name(s) 3-(4-Methoxyphenyl)benzo[c]isoxazole-5,6-dicarbonitrile
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H9N3O2
InChI InChI=1S/C16H9N3O2/c1-20-13-4-2-10(3-5-13)16-14-6-11(8-17)12(9-18)7-15(14)19-21-16/h2-7H,1H3
InChIKey UPJKUAUCTYOGDH-UHFFFAOYSA-N
Molecular Weight 275.267 g/mol
SMILES c12c(onc2cc(c(c1)C#N)C#N)-c1ccc(cc1)OC
SPLASH splash10-004i-4290000000-e20e7c78d1819dee98b5
Source of Spectrum HC-48-432-6b
Wiley ID 1739229