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Phthalazone
SpectraBase Compound ID 6GczYSSXtAV
InChI InChI=1S/C8H6N2O/c11-8-7-4-2-1-3-6(7)5-9-10-8/h1-5H,(H,10,11)
InChIKey IJAPPYDYQCXOEF-UHFFFAOYSA-N
Mol Weight 146.15 g/mol
Molecular Formula C8H6N2O
Exact Mass 146.048013 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8vKWjU6lsOG
Name Phthalazinone
CAS Registry Number 119-39-1
Classification Chemical
Comments Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found)
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 146.048012820 u
Formula C8H6N2O
InChI InChI=1S/C8H6N2O/c11-8-7-4-2-1-3-6(7)5-9-10-8/h1-5H,(H,10,11)
InChIKey IJAPPYDYQCXOEF-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 146.149 g/mol
Nominal Mass 146 u
Quality 818
Retention Index 1280
SMILES C=12C(C=NNC2=O)=CC=CC1
SPLASH splash10-000b-9700000000-a27065bb5ffbfb729d90
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 2H-Phthalazin-1-one
Technique GC/MS
Wiley ID DD2024_003640