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2,1-Benzisoxazole, 6-chloro-3-phenyl-
SpectraBase Compound ID ISiDix7RDso
InChI InChI=1S/C13H8ClNO/c14-10-6-7-11-12(8-10)15-16-13(11)9-4-2-1-3-5-9/h1-8H
InChIKey NUTYACOPMRCCDT-UHFFFAOYSA-N
Mol Weight 229.67 g/mol
Molecular Formula C13H8ClNO
Exact Mass 229.029442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ElIXGbDQOv5
Name 2,1-Benzisoxazole, 6-chloro-3-phenyl-
CAS Registry Number 24400-58-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H8ClNO
InChI InChI=1S/C13H8ClNO/c14-10-6-7-11-12(8-10)15-16-13(11)9-4-2-1-3-5-9/h1-8H
InChIKey NUTYACOPMRCCDT-UHFFFAOYSA-N
Molecular Weight 229.666 g/mol
SMILES c12c(onc2cc(cc1)Cl)-c1ccccc1
SPLASH splash10-0ufr-9130000000-04b05782120a74c49f99
Source of Spectrum B-41-1239-0
Synonyms 6-Chloro-3-phenyl-2,1-benzisoxazole 6-Chloro-3-phenyl-2,1-benzoxazole 6-Chloranyl-3-phenyl-2,1-benzoxazole
Wiley ID 1230722