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2-Phenyl-1,2,3,4-tetrahydrophthalazin-1-one

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

2-Phenyl-1,2,3,4-tetrahydrophthalazin-1-one
SpectraBase Compound ID 2RYbQ0FkKT2
InChI InChI=1S/C14H12N2O/c17-14-13-9-5-4-6-11(13)10-15-16(14)12-7-2-1-3-8-12/h1-9,15H,10H2
InChIKey CBSKPROWQGQDOW-UHFFFAOYSA-N
Mol Weight 224.26 g/mol
Molecular Formula C14H12N2O
Exact Mass 224.094963 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 1Cs3J2CHSKK
Name 2-Phenyl-1,2,3,4-tetrahydrophthalazin-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 224.094963013 u
Formula C14H12N2O
InChI InChI=1S/C14H12N2O/c17-14-13-9-5-4-6-11(13)10-15-16(14)12-7-2-1-3-8-12/h1-9,15H,10H2
InChIKey CBSKPROWQGQDOW-UHFFFAOYSA-N
Molecular Weight 224.263 g/mol
SMILES C1(N(NCC=2C=CC=CC12)C=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.806337