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2,1-Benzisoxazole-6-carboxylic acid, 5-chloro-3-phenyl-

View entire compound with spectra: 2 MS (GC)

2,1-Benzisoxazole-6-carboxylic acid, 5-chloro-3-phenyl-
SpectraBase Compound ID InuF32Weg5e
InChI InChI=1S/C14H8ClNO3/c15-11-6-10-12(7-9(11)14(17)18)16-19-13(10)8-4-2-1-3-5-8/h1-7H,(H,17,18)
InChIKey AODFWNQXKGIUQZ-UHFFFAOYSA-N
Mol Weight 273.67 g/mol
Molecular Formula C14H8ClNO3
Exact Mass 273.019271 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5cEEh5e3RE5
Name 2,1-Benzisoxazole-6-carboxylic acid, 5-chloro-3-phenyl-
CAS Registry Number 41051-97-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H8ClNO3
InChI InChI=1S/C14H8ClNO3/c15-11-6-10-12(7-9(11)14(17)18)16-19-13(10)8-4-2-1-3-5-8/h1-7H,(H,17,18)
InChIKey AODFWNQXKGIUQZ-UHFFFAOYSA-N
Molecular Weight 273.675 g/mol
SMILES OC(c1cc2c(cc1Cl)c(-c1ccccc1)on2)=O
SPLASH splash10-00fr-5390000000-f021ce94d6ccba9dd51b
Synonyms 5-Chloranyl-3-phenyl-2,1-benzoxazole-6-carboxylic acid 5-Chloro-3-phenyl-2,1-benzisoxazole-6-carboxylic acid 5-Chloro-3-phenyl-2,1-benzoxazole-6-carboxylic acid 5-Chloro-3-phenyl-anthranil-6-carboxylic acid
Wiley ID 1490489