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6-Methylflavanone, azine

View entire compound with spectra: 2 NMR, and 1 FTIR

6-Methylflavanone, azine
SpectraBase Compound ID 1I6p8EKsrI7
InChI InChI=1S/C32H28N2O2/c1-21-13-15-29-25(17-21)27(19-31(35-29)23-9-5-3-6-10-23)33-34-28-20-32(24-11-7-4-8-12-24)36-30-16-14-22(2)18-26(28)30/h3-18,31-32H,19-20H2,1-2H3/b33-27-,34-28+/t31-,32-/m0/s1
InChIKey JPLAKWPZYFXSIC-LXLHNYDASA-N
Mol Weight 472.6 g/mol
Molecular Formula C32H28N2O2
Exact Mass 472.215078 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID LAqffuaNSH0
Name 6-Methylflavanone, azine
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 472.215078148 u
Formula C32H28N2O2
InChI InChI=1S/C32H28N2O2/c1-21-13-15-29-25(17-21)27(19-31(35-29)23-9-5-3-6-10-23)33-34-28-20-32(24-11-7-4-8-12-24)36-30-16-14-22(2)18-26(28)30/h3-18,31-32H,19-20H2,1-2H3/b33-27-,34-28+/t31-,32-/m0/s1
InChIKey JPLAKWPZYFXSIC-LXLHNYDASA-N
Molecular Weight 472.588 g/mol
SMILES C=12C=CC(=CC1\C(C[C@](O2)(C=1C=CC=CC1)[H])=N\N=C/1C=2C=C(C=CC2O[C@@](C1)(C=1C=CC=CC1)[H])C)C