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Ethaneperoxoic acid, 1-cyano-1,4-diphenylbutyl ester
SpectraBase Compound ID AuMpQaYQjV7
InChI InChI=1S/C19H19NO3/c1-16(21)22-23-19(15-20,18-12-6-3-7-13-18)14-8-11-17-9-4-2-5-10-17/h2-7,9-10,12-13H,8,11,14H2,1H3
InChIKey MMZVFPJIJDEWMC-UHFFFAOYSA-N
Mol Weight 309.37 g/mol
Molecular Formula C19H19NO3
Exact Mass 309.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Eo8YGnWfkza
Name Ethaneperoxoic acid, 1-cyano-1,4-diphenylbutyl ester
CAS Registry Number 58422-76-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19NO3
InChI InChI=1S/C19H19NO3/c1-16(21)22-23-19(15-20,18-12-6-3-7-13-18)14-8-11-17-9-4-2-5-10-17/h2-7,9-10,12-13H,8,11,14H2,1H3
InChIKey MMZVFPJIJDEWMC-UHFFFAOYSA-N
Molecular Weight 309.365 g/mol
SMILES CC(=O)OOC(CCCc1ccccc1)(C#N)c1ccccc1
SPLASH splash10-05fr-0910000000-23b33007c5e2c3cb7d5c
Source of Spectrum C-99-1540-0
Synonyms 1-Cyano-1,4-diphenylbutyl ethaneperoxoate (1-cyano-1,4-diphenyl-butyl) peroxyacetate peracetic acid (1-cyano-1,4-diphenyl-butyl) ester Ethaneperoxoic acid (1-cyano-1,4-diphenylbutyl) ester (1-cyano-1,4-diphenylbutyl) ethaneperoxoate
Wiley ID 1310751