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1H-Pyrazole-4,5-dione, 3-amino-, 4-phenylhydrazone

View entire compound with spectra: 1 FTIR, and 2 MS (GC)

1H-Pyrazole-4,5-dione, 3-amino-, 4-phenylhydrazone
SpectraBase Compound ID 2gWrAkUKSeR
InChI InChI=1S/C9H9N5O/c10-8-7(9(15)14-13-8)12-11-6-4-2-1-3-5-6/h1-5,11H,(H3,10,12,13,14,15)
InChIKey VPVPYJCRBGQLRB-UHFFFAOYSA-N
Mol Weight 203.21 g/mol
Molecular Formula C9H9N5O
Exact Mass 203.08071 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 6dhrFov6qdT
Name 1H-Pyrazole-4,5-dione, 3-amino-, 4-phenylhydrazone
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 203.080709929 u
Formula C9H9N5O
InChI InChI=1S/C9H9N5O/c10-8-7(9(15)14-13-8)12-11-6-4-2-1-3-5-6/h1-5,11H,(H3,10,12,13,14,15)
InChIKey VPVPYJCRBGQLRB-UHFFFAOYSA-N
Molecular Weight 203.205 g/mol
SMILES C1(NN=C(\C1=N/NC=1C=CC=CC1)N)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.891989