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2-(1-Benzyl-1H-pyrazol-4-ylmethylene)-1H-indene-1,3(2H)-dione

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

2-(1-Benzyl-1H-pyrazol-4-ylmethylene)-1H-indene-1,3(2H)-dione
SpectraBase Compound ID Ejk206YI3qt
InChI InChI=1S/C20H14N2O2/c23-19-16-8-4-5-9-17(16)20(24)18(19)10-15-11-21-22(13-15)12-14-6-2-1-3-7-14/h1-11,13H,12H2
InChIKey HWKAKMPXCNOSHL-UHFFFAOYSA-N
Mol Weight 314.34 g/mol
Molecular Formula C20H14N2O2
Exact Mass 314.105528 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FwS3f7qwkQT
Name 2-(1-Benzyl-1H-pyrazol-4-ylmethylene)-1H-indene-1,3(2H)-dione
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 314.105527697 u
Formula C20H14N2O2
InChI InChI=1S/C20H14N2O2/c23-19-16-8-4-5-9-17(16)20(24)18(19)10-15-11-21-22(13-15)12-14-6-2-1-3-7-14/h1-11,13H,12H2
InChIKey HWKAKMPXCNOSHL-UHFFFAOYSA-N
Molecular Weight 314.344 g/mol
SMILES C1(C(C=2C=CC=CC2C1=O)=O)=CC1=CN(CC2=CC=CC=C2)N=C1