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4-tert-Butylcyclohexyl 2-[(4-methylbenzene)amido]benzoate
SpectraBase Compound ID IePU1xWMoli
InChI InChI=1S/C25H31NO3/c1-17-9-11-18(12-10-17)23(27)26-22-8-6-5-7-21(22)24(28)29-20-15-13-19(14-16-20)25(2,3)4/h5-12,19-20H,13-16H2,1-4H3,(H,26,27)
InChIKey BIXOERGIOFNVIW-UHFFFAOYSA-N
Mol Weight 393.53 g/mol
Molecular Formula C25H31NO3
Exact Mass 393.230394 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JajJUck8218
Name 4-tert-Butylcyclohexyl 2-[(4-methylbenzene)amido]benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H31NO3
InChI InChI=1S/C25H31NO3/c1-17-9-11-18(12-10-17)23(27)26-22-8-6-5-7-21(22)24(28)29-20-15-13-19(14-16-20)25(2,3)4/h5-12,19-20H,13-16H2,1-4H3,(H,26,27)
InChIKey BIXOERGIOFNVIW-UHFFFAOYSA-N
Molecular Weight 393.527 g/mol
SMILES N(C(c1ccc(cc1)C)=O)c1c(C(OC2CCC(C(C)(C)C)CC2)=O)cccc1
SPLASH splash10-014l-2935000000-db492cb742d310f6698d
Source of Spectrum IY-2-5182-2
Synonyms Benzoic acid, 2-[(4-methylbenzoyl)amino]-, 4-(1,1-dimethylethyl)cyclohexyl ester 2-[[(4-methylphenyl)-oxomethyl]amino]benzoic acid (4-tert-butylcyclohexyl) ester (4-tert-butylcyclohexyl) 2-[(4-methylbenzoyl)amino]benzoate (4-tert-butylcyclohexyl) 2-[(4-methylphenyl)carbonylamino]benzoate
Wiley ID 1659805