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2-[1-(3-Methylbenzyl)-1,4-dihydropyridin-4-ylidene]-indan-1,3-dione

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

2-[1-(3-Methylbenzyl)-1,4-dihydropyridin-4-ylidene]-indan-1,3-dione
SpectraBase Compound ID UjPudMzOvG
InChI InChI=1S/C22H17NO2/c1-15-5-4-6-16(13-15)14-23-11-9-17(10-12-23)20-21(24)18-7-2-3-8-19(18)22(20)25/h2-13H,14H2,1H3
InChIKey LKMWZWMAFYSPSQ-UHFFFAOYSA-N
Mol Weight 327.38 g/mol
Molecular Formula C22H17NO2
Exact Mass 327.125929 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GeAIn30CTXo
Name 2-[1-(3-Methylbenzyl)-1,4-dihydropyridin-4-ylidene]-indan-1,3-dione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 327.125928789 u
Formula C22H17NO2
InChI InChI=1S/C22H17NO2/c1-15-5-4-6-16(13-15)14-23-11-9-17(10-12-23)20-21(24)18-7-2-3-8-19(18)22(20)25/h2-13H,14H2,1H3
InChIKey LKMWZWMAFYSPSQ-UHFFFAOYSA-N
Molecular Weight 327.383 g/mol
SMILES C(N1C=CC(C=C1)=C1C(C2=CC=CC=C2C1=O)=O)C1=CC=CC(=C1)C