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N,N'-bis(1'-Phenylethyl)-N,N'-bis(trifluoroacetyl)-1,2-diaminocyclohex-4-ene

View entire compound with spectra: 1 MS (GC)

N,N'-bis(1'-Phenylethyl)-N,N'-bis(trifluoroacetyl)-1,2-diaminocyclohex-4-ene
SpectraBase Compound ID 8qmc7s9ih9i
InChI InChI=1S/C26H26F6N2O2/c1-17(19-11-5-3-6-12-19)33(23(35)25(27,28)29)21-15-9-10-16-22(21)34(24(36)26(30,31)32)18(2)20-13-7-4-8-14-20/h3-14,17-18,21-22H,15-16H2,1-2H3
InChIKey UEQZOUFRRHNOBJ-UHFFFAOYSA-N
Mol Weight 512.5 g/mol
Molecular Formula C26H26F6N2O2
Exact Mass 512.189847 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GIdboOR5bUa
Name N,N'-bis(1'-Phenylethyl)-N,N'-bis(trifluoroacetyl)-1,2-diaminocyclohex-4-ene
Alternate Name(s) 2,2,2-trifluoro-N-(1-phenylethyl)-N-{6-[(1-phenylethyl)(trifluoroacetyl)amino]-3-cyclohexen-1-yl}acetamide
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H26F6N2O2
InChI InChI=1S/C26H26F6N2O2/c1-17(19-11-5-3-6-12-19)33(23(35)25(27,28)29)21-15-9-10-16-22(21)34(24(36)26(30,31)32)18(2)20-13-7-4-8-14-20/h3-14,17-18,21-22H,15-16H2,1-2H3
InChIKey UEQZOUFRRHNOBJ-UHFFFAOYSA-N
Molecular Weight 512.496 g/mol
SMILES C1(C(CC=CC1)N(C(=O)C(F)(F)F)C(C)c1ccccc1)N(C(=O)C(F)(F)F)C(C)c1ccccc1
SPLASH splash10-0a4i-0900000000-c0b3fdcbc8ac05ef22f9
Source of Spectrum U1-1999-1525-12
Wiley ID 753182