John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=77j7f82lzCp SpectraBase Spectrum ID=1058LQ5LUio

(accessed ).
3-(1-acetyl-3,5-dimethylpyrazol-4-yl)-5-chloro-2,1-benzisoxazole
SpectraBase Compound ID 77j7f82lzCp
InChI InChI=1S/C14H12ClN3O2/c1-7-13(8(2)18(16-7)9(3)19)14-11-6-10(15)4-5-12(11)17-20-14/h4-6H,1-3H3
InChIKey RNPSGZSUQLQRQC-UHFFFAOYSA-N
Mol Weight 289.72 g/mol
Molecular Formula C14H12ClN3O2
Exact Mass 289.061804 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 1058LQ5LUio
Name 3-(1-ACETYL-3,5-DIMETHYLPYRAZOL-4-YL)-5-CHLORO-2,1-BENZISOXAZOLE
Source of Sample T. KURIHARA, OSAKA COLLEGE OF PHARMACY, OSAKA, JAPAN
Copyright Copyright © 1980, 1981-2020 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H12ClN3O2
InChI InChI=1S/C14H12ClN3O2/c1-7-13(8(2)18(16-7)9(3)19)14-11-6-10(15)4-5-12(11)17-20-14/h4-6H,1-3H3
InChIKey RNPSGZSUQLQRQC-UHFFFAOYSA-N
Literature Reference CHEM. PHARM. BULL. TOKYO 26, 1141(1978) Abstract-Chemical Abstracts= 89, 163486(1978)
Molecular Weight 289.718994
SpectraBase Batch ID 1xGjZ1oqGyY
Synonyms 2,1-BENZISOXAZOLE, 3-/1-ACETYL-3,5-DI- METHYLPYRAZOL-4-YL/-5-CHLORO-,
Technique KBr WAFER