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2,1-Benzisoxazole, 5-nitro-3-phenyl-
SpectraBase Compound ID 5UAVXPD2JUO
InChI InChI=1S/C13H8N2O3/c16-15(17)10-6-7-12-11(8-10)13(18-14-12)9-4-2-1-3-5-9/h1-8H
InChIKey HEGUBBKOVGZOPQ-UHFFFAOYSA-N
Mol Weight 240.22 g/mol
Molecular Formula C13H8N2O3
Exact Mass 240.053492 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GGIHXpsobFm
Name 2,1-Benzisoxazole, 5-nitro-3-phenyl-
CAS Registry Number 38735-62-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8N2O3
InChI InChI=1S/C13H8N2O3/c16-15(17)10-6-7-12-11(8-10)13(18-14-12)9-4-2-1-3-5-9/h1-8H
InChIKey HEGUBBKOVGZOPQ-UHFFFAOYSA-N
Molecular Weight 240.218 g/mol
SMILES c12c(onc2ccc(N(=O)=O)c1)-c1ccccc1
SPLASH splash10-002f-9780000000-1a285073d5f09dcc720e
Source of Spectrum B-41-1240-0
Synonyms 5-Nitro-3-phenyl-2,1-benzoxazole 5-Nitro-3-phenyl-anthranil
Wiley ID 1242785