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2,1-Benzisoxazole, 5-(4-bromophenyl)-3-phenyl-
SpectraBase Compound ID IUow2jv3j56
InChI InChI=1S/C19H12BrNO/c20-16-9-6-13(7-10-16)15-8-11-18-17(12-15)19(22-21-18)14-4-2-1-3-5-14/h1-12H
InChIKey LNTUAMHHJGIBQF-UHFFFAOYSA-N
Mol Weight 350.22 g/mol
Molecular Formula C19H12BrNO
Exact Mass 349.010227 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JiXVqJs7cb7
Name 2,1-Benzisoxazole, 5-(4-bromophenyl)-3-phenyl-
Alternate Name(s) 5-(4-bromophenyl)-3-phenyl-2,1-benzisoxazole 5-Bromophenyl-7-phenylbenzisoxazole
CAS Registry Number 69751-79-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H12BrNO
InChI InChI=1S/C19H12BrNO/c20-16-9-6-13(7-10-16)15-8-11-18-17(12-15)19(22-21-18)14-4-2-1-3-5-14/h1-12H
InChIKey LNTUAMHHJGIBQF-UHFFFAOYSA-N
Molecular Weight 350.215 g/mol
SMILES c12c(onc2ccc(c1)-c1ccc(cc1)Br)-c1ccccc1
SPLASH splash10-0fmv-9817000000-999925dec2cf7535f9fe
Source of Spectrum H-62-203-0
Wiley ID 1341350