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2,1-Benzisoxazole-5-carboxylic acid, 3-phenyl-
SpectraBase Compound ID 9SH98BGPVhq
InChI InChI=1S/C14H9NO3/c16-14(17)10-6-7-12-11(8-10)13(18-15-12)9-4-2-1-3-5-9/h1-8H,(H,16,17)
InChIKey GEBDBXYYQHUKAU-UHFFFAOYSA-N
Mol Weight 239.23 g/mol
Molecular Formula C14H9NO3
Exact Mass 239.058243 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FRlNZLR3znS
Name 2,1-Benzisoxazole-5-carboxylic acid, 3-phenyl-
Alternate Name(s) 3-Phenylbenzo[c]isoxazole-5-carboxylic acid 3-Phenyl-2,1-benzoxazole-5-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H9NO3
InChI InChI=1S/C14H9NO3/c16-14(17)10-6-7-12-11(8-10)13(18-15-12)9-4-2-1-3-5-9/h1-8H,(H,16,17)
InChIKey GEBDBXYYQHUKAU-UHFFFAOYSA-N
Molecular Weight 239.230 g/mol
SMILES OC(=O)c1ccc2noc(-c3ccccc3)c2c1
SPLASH splash10-000i-4790000000-d466786ca4e858345b1f
Source of Spectrum JX-2015-1-210
Wiley ID 1721058