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4-Benzylamino-1-oxo-1,2-dihydrophthalazine

View entire compound with spectra: 1 FTIR

4-Benzylamino-1-oxo-1,2-dihydrophthalazine
SpectraBase Compound ID J1xlY6JD42W
InChI InChI=1S/C15H13N3O/c19-15-13-9-5-4-8-12(13)14(17-18-15)16-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,16,17)(H,18,19)
InChIKey XIBKLTSPKVNVHL-UHFFFAOYSA-N
Mol Weight 251.29 g/mol
Molecular Formula C15H13N3O
Exact Mass 251.105862 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID IJG81m4Qb3K
Name 4-Benzylamino-1-oxo-1,2-dihydrophthalazine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 251.105862050 u
Formula C15H13N3O
InChI InChI=1S/C15H13N3O/c19-15-13-9-5-4-8-12(13)14(17-18-15)16-10-11-6-2-1-3-7-11/h1-9H,10H2,(H,16,17)(H,18,19)
InChIKey XIBKLTSPKVNVHL-UHFFFAOYSA-N
Molecular Weight 251.289 g/mol
SMILES C12=C(C=CC=C2)C(NN=C1NCC=1C=CC=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.894211