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N'-cyclohexylidene-2,6-bis(4-methylphenyl)isonicotinohydrazide
SpectraBase Compound ID L6PDHTYGn2z
InChI InChI=1S/C26H27N3O/c1-18-8-12-20(13-9-18)24-16-22(26(30)29-28-23-6-4-3-5-7-23)17-25(27-24)21-14-10-19(2)11-15-21/h8-17H,3-7H2,1-2H3,(H,29,30)
InChIKey QHMPBZWKBBIXMY-UHFFFAOYSA-N
Mol Weight 397.52 g/mol
Molecular Formula C26H27N3O
Exact Mass 397.215413 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID G4GBV2hSTrH
Name N'-Cyclohexylidene-2,6-bis(4-methylphenyl)isonicotinohydrazide
Comments Computed using HOSE algorithm
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Exact Mass 397.215412500 u
Formula C26H27N3O
InChI InChI=1S/C26H27N3O/c1-18-8-12-20(13-9-18)24-16-22(26(30)29-28-23-6-4-3-5-7-23)17-25(27-24)21-14-10-19(2)11-15-21/h8-17H,3-7H2,1-2H3,(H,29,30)
InChIKey QHMPBZWKBBIXMY-UHFFFAOYSA-N
Molecular Weight 397.522 g/mol
SMILES N(C(C=1C=C(N=C(C1)C1=CC=C(C)C=C1)C1=CC=C(C=C1)C)=O)N=C1CCCCC1