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Pyridazine-3,6(1H,2H)-dione, 1-(4-ethylphenyl)-

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

Pyridazine-3,6(1H,2H)-dione, 1-(4-ethylphenyl)-
SpectraBase Compound ID F015Xpi91up
InChI InChI=1S/C12H12N2O2/c1-2-9-3-5-10(6-4-9)14-12(16)8-7-11(15)13-14/h3-8H,2H2,1H3,(H,13,15)
InChIKey JMQAUQCEXRQVHE-UHFFFAOYSA-N
Mol Weight 216.24 g/mol
Molecular Formula C12H12N2O2
Exact Mass 216.089878 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID JAvUK55kkee
Name Pyridazine-3,6(1H,2H)-dione, 1-(4-ethylphenyl)-
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 216.089877632 u
Formula C12H12N2O2
InChI InChI=1S/C12H12N2O2/c1-2-9-3-5-10(6-4-9)14-12(16)8-7-11(15)13-14/h3-8H,2H2,1H3,(H,13,15)
InChIKey JMQAUQCEXRQVHE-UHFFFAOYSA-N
Molecular Weight 216.240 g/mol
SMILES CCC1=CC=C(N2C(C=CC(N2)=O)=O)C=C1
Spectrum/Structure Validation Score (Vapor Phase IR) 0.960303