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3-[(4-Phenyl-1-piperazinyl)methylene]phthalide

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

3-[(4-Phenyl-1-piperazinyl)methylene]phthalide
SpectraBase Compound ID 3N7cPFUH7Q
InChI InChI=1S/C19H18N2O2/c22-19-17-9-5-4-8-16(17)18(23-19)14-20-10-12-21(13-11-20)15-6-2-1-3-7-15/h1-9,14H,10-13H2
InChIKey AUZZAWWMAVSJOU-UHFFFAOYSA-N
Mol Weight 306.37 g/mol
Molecular Formula C19H18N2O2
Exact Mass 306.136828 g/mol

Raman Spectrum

Raman Spectrum

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SpectraBase Spectrum ID FCNZfP6DkO8
Name 3-[(4-Phenyl-1-piperazinyl)methylene]phthalide
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 306.136827826 u
Formula C19H18N2O2
InChI InChI=1S/C19H18N2O2/c22-19-17-9-5-4-8-16(17)18(23-19)14-20-10-12-21(13-11-20)15-6-2-1-3-7-15/h1-9,14H,10-13H2
InChIKey AUZZAWWMAVSJOU-UHFFFAOYSA-N
Molecular Weight 306.365 g/mol
SMILES C1(OC(=O)C2=C1C=CC=C2)=CN1CCN(CC1)C=1C=CC=CC1
Spectrum/Structure Validation Score (Raman) 0.876211