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.alpha.-Mesitylacetophenone ketazine

View entire compound with spectra: 1 NMR, and 1 MS (GC)

.alpha.-Mesitylacetophenone ketazine
SpectraBase Compound ID ESeS2utDSJZ
InChI InChI=1S/C34H36N2/c1-23-17-25(3)31(26(4)18-23)21-33(29-13-9-7-10-14-29)35-36-34(30-15-11-8-12-16-30)22-32-27(5)19-24(2)20-28(32)6/h7-20H,21-22H2,1-6H3/b35-33-,36-34+
InChIKey XKNVIVZCLDZWEV-FFROBNHHSA-N
Mol Weight 472.7 g/mol
Molecular Formula C34H36N2
Exact Mass 472.287849 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3HMCuuqVfeu
Name .alpha.-Mesitylacetophenone ketazine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 472.287849167 u
Formula C34H36N2
InChI InChI=1S/C34H36N2/c1-23-17-25(3)31(26(4)18-23)21-33(29-13-9-7-10-14-29)35-36-34(30-15-11-8-12-16-30)22-32-27(5)19-24(2)20-28(32)6/h7-20H,21-22H2,1-6H3/b35-33-,36-34+
InChIKey XKNVIVZCLDZWEV-FFROBNHHSA-N
Molecular Weight 472.676 g/mol
SMILES C1(C\C(=N\N=C/(CC=2C(=CC(=CC2C)C)C)C2=CC=CC=C2)C=2C=CC=CC2)=C(C=C(C=C1C)C)C