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3-Phenyl-1,2-benzisoxazole 2-oxide
SpectraBase Compound ID DWFcpQCdgi7
InChI InChI=1S/C13H9NO2/c15-14-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)16-14/h1-9H
InChIKey PTUZTCIWMZSRGE-UHFFFAOYSA-N
Mol Weight 211.22 g/mol
Molecular Formula C13H9NO2
Exact Mass 211.063329 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6dfn3Bi3OBM
Name 1,2-Benzisoxazole, 3-phenyl-, 2-oxide
CAS Registry Number 97937-84-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H9NO2
InChI InChI=1S/C13H9NO2/c15-14-13(10-6-2-1-3-7-10)11-8-4-5-9-12(11)16-14/h1-9H
InChIKey PTUZTCIWMZSRGE-UHFFFAOYSA-N
Molecular Weight 211.220 g/mol
SMILES c1([n+](oc2ccccc12)[O-])-c1ccccc1
SPLASH splash10-0ue9-1910000000-8c3120c52b48f2553750
Source of Spectrum Y-22-690-10
Synonyms 2-Oxidanidyl-3-phenyl-1,2-benzoxazol-2-ium 2-Oxido-3-phenyl-1,2-benzoxazol-2-ium 2-Oxido-3-phenyl-indoxazen-2-ium
Wiley ID 1210512