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5-chloro-2-(morpholinomethyl)-1,2-benzisoxazolin-3-one

View entire compound with spectra: 1 NMR, and 1 FTIR

5-chloro-2-(morpholinomethyl)-1,2-benzisoxazolin-3-one
SpectraBase Compound ID IKDqkh3ZhoD
InChI InChI=1S/C12H13ClN2O3/c13-9-1-2-11-10(7-9)12(16)15(18-11)8-14-3-5-17-6-4-14/h1-2,7H,3-6,8H2
InChIKey BCCJPDCDLILCQB-UHFFFAOYSA-N
Mol Weight 268.7 g/mol
Molecular Formula C12H13ClN2O3
Exact Mass 268.06147 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID 1dZJLagMVqw
Name 5-CHLORO-2-(MORPHOLINOMETHYL)-1,2-BENZISOXAZOLIN-3-ONE
Source of Sample I. Bien and E. Domagalina, Medical Academy of Lublin, Lublin, Poland
Copyright Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H13ClN2O3
InChI InChI=1S/C12H13ClN2O3/c13-9-1-2-11-10(7-9)12(16)15(18-11)8-14-3-5-17-6-4-14/h1-2,7H,3-6,8H2
InChIKey BCCJPDCDLILCQB-UHFFFAOYSA-N
Literature Reference ACTA POLON. PHARM. 38, 41(1981) Abstract-Chemical Abstracts= 96, 85453(1982)
Melting Point 132-134C
Molecular Weight 268.696991
Synonyms 1,2-BENZISOXAZOLIN-3-ONE, 5-CHLORO- 2-/MORPHOLINOMETHYL/-,
Technique FILM (CAST FROM CHCl3)