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N-(3-(4-butylphenyl)-1-(cyclohexylimino)prop-2-ynyl)-N-cyclohexylbenzamide
SpectraBase Compound ID 7xVcthOyMO1
InChI InChI=1S/C32H40N2O/c1-2-3-13-26-20-22-27(23-21-26)24-25-31(33-29-16-9-5-10-17-29)34(30-18-11-6-12-19-30)32(35)28-14-7-4-8-15-28/h4,7-8,14-15,20-23,29-30H,2-3,5-6,9-13,16-19H2,1H3/b33-31+
InChIKey DRRJUZNXACDUOS-QOSDPKFLSA-N
Mol Weight 468.7 g/mol
Molecular Formula C32H40N2O
Exact Mass 468.314064 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3jQndcnnYmM
Name N-(3-(4-butylphenyl)-1-(cyclohexylimino)prop-2-ynyl)-N-cyclohexylbenzamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C32H40N2O
InChI InChI=1S/C32H40N2O/c1-2-3-13-26-20-22-27(23-21-26)24-25-31(33-29-16-9-5-10-17-29)34(30-18-11-6-12-19-30)32(35)28-14-7-4-8-15-28/h4,7-8,14-15,20-23,29-30H,2-3,5-6,9-13,16-19H2,1H3/b33-31+
InChIKey DRRJUZNXACDUOS-QOSDPKFLSA-N
Literature Reference DOI 10.1002/adsc.200700333
Molecular Weight 468.685 g/mol
SMILES C1(\N=C/(C#Cc2ccc(cc2)CCCC)N(C(=O)c2ccccc2)C2CCCCC2)CCCCC1
SPLASH splash10-0bu9-0905300000-12176b35ba1acf9c15d7
Source of Spectrum ASC-350-61/SM5-4n
Synonyms (E)-N-(3-(4-butylphenyl)-1-(cyclohexylimino)prop-2-yn-1-yl)-N-cyclohexylbenzamide
Wiley ID 1765687