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(4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetic acid
SpectraBase Compound ID DML1mApj45f
InChI InChI=1S/C9H7N3O3/c13-8(14)5-12-9(15)6-3-1-2-4-7(6)10-11-12/h1-4H,5H2,(H,13,14)
InChIKey SPFIHLPNCSLCNZ-UHFFFAOYSA-N
Mol Weight 205.17 g/mol
Molecular Formula C9H7N3O3
Exact Mass 205.048741 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LghNve07XTE
Name (4-oxo-1,2,3-benzotriazin-3(4H)-yl)acetic acid
CAS Registry Number 97609-01-3
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7N3O3
InChI InChI=1S/C9H7N3O3/c13-8(14)5-12-9(15)6-3-1-2-4-7(6)10-11-12/h1-4H,5H2,(H,13,14)
InChIKey SPFIHLPNCSLCNZ-UHFFFAOYSA-N
Molecular Weight 205.173 g/mol
SMILES OC(CN1N=Nc2c(C1=O)cccc2)=O
SPLASH splash10-0059-6900000000-8129aac521552796431c
Source of Spectrum H-68-897-6
Synonyms 2-(4-keto-1,2,3-benzotriazin-3-yl)acetic acid 2-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)ethanoic acid 2-(4-oxo-1,2,3-benzotriazin-3-yl)acetic acid
Wiley ID 1203223