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Ethaneperoxoic acid, cyanocyclohexylphenylmethyl ester

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Ethaneperoxoic acid, cyanocyclohexylphenylmethyl ester
SpectraBase Compound ID 5Q7uwOJ2qMU
InChI InChI=1S/C16H19NO3/c1-13(18)19-20-16(12-17,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2,4-5,8-9,15H,3,6-7,10-11H2,1H3
InChIKey JEEKVPYWKMIRQE-UHFFFAOYSA-N
Mol Weight 273.33 g/mol
Molecular Formula C16H19NO3
Exact Mass 273.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 68oItzX3g4c
Name Ethaneperoxoic acid, cyanocyclohexylphenylmethyl ester
CAS Registry Number 58422-78-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H19NO3
InChI InChI=1S/C16H19NO3/c1-13(18)19-20-16(12-17,14-8-4-2-5-9-14)15-10-6-3-7-11-15/h2,4-5,8-9,15H,3,6-7,10-11H2,1H3
InChIKey JEEKVPYWKMIRQE-UHFFFAOYSA-N
Molecular Weight 273.332 g/mol
SMILES CC(=O)OOC(C#N)(c1ccccc1)C1CCCCC1
SPLASH splash10-0a4i-0900000000-cd37e627ff94a2ff3021
Source of Spectrum C-99-1540-0
Synonyms Cyano(cyclohexyl)phenylmethyl ethaneperoxoate (cyano-cyclohexyl-phenyl-methyl) peroxyacetate peracetic acid (cyano-cyclohexyl-phenyl-methyl) ester Ethaneperoxoic acid (cyano-cyclohexyl-phenylmethyl) ester (cyano-cyclohexyl-phenylmethyl) ethaneperoxoate
Wiley ID 1277291