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3-Isoxazolecarboperoxoic acid, 4,5-dihydro-5-phenyl-, 1,1-dimethylethyl ester
SpectraBase Compound ID 8i2KPaeIOnf
InChI InChI=1S/C14H17NO4/c1-14(2,3)19-18-13(16)11-9-12(17-15-11)10-7-5-4-6-8-10/h4-8,12H,9H2,1-3H3
InChIKey SIGBCOWCWBYQSE-UHFFFAOYSA-N
Mol Weight 263.29 g/mol
Molecular Formula C14H17NO4
Exact Mass 263.115758 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JjLUztuLeoZ
Name 3-Isoxazolecarboperoxoic acid, 4,5-dihydro-5-phenyl-, 1,1-dimethylethyl ester
CAS Registry Number 35145-84-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H17NO4
InChI InChI=1S/C14H17NO4/c1-14(2,3)19-18-13(16)11-9-12(17-15-11)10-7-5-4-6-8-10/h4-8,12H,9H2,1-3H3
InChIKey SIGBCOWCWBYQSE-UHFFFAOYSA-N
Molecular Weight 263.293 g/mol
SMILES CC(C)(C)OOC(C=1CC(c2ccccc2)ON1)=O
SPLASH splash10-0a4l-9200000000-a99d60d0a86ab676de0f
Source of Spectrum KI-0-3-0
Synonyms tert-Butyl 5-phenyl-4,5-dihydro-3-isoxazolecarboperoxoate 5-Phenyl-2-isoxazoline-3-carboperoxoic acid tert-butyl ester 5-Phenyl-4,5-dihydroisoxazole-3-carboperoxoic acid tert-butyl ester tert-Butyl 5-phenyl-4,5-dihydro-1,2-oxazole-3-carboperoxoate tert-Butyl 5-phenyl-4,5-dihydroisoxazole-3-carboperoxoate
Wiley ID 1266836