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5,6,7-Trichloro-1,2,3-benzotriazin-4(3H)-one
SpectraBase Compound ID LsUbEhIq9HU
InChI InChI=1S/C7H2Cl3N3O/c8-2-1-3-4(6(10)5(2)9)7(14)12-13-11-3/h1H,(H,11,12,14)
InChIKey NFRLOQWIOYJYOA-UHFFFAOYSA-N
Mol Weight 250.47 g/mol
Molecular Formula C7H2Cl3N3O
Exact Mass 248.926345 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1RZXFane3ak
Name 5,6,7-Trichloro-1,2,3-benzotriazin-4(3H)-one
Comments Removed - expert review: column bleed
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H2Cl3N3O
InChI InChI=1S/C7H2Cl3N3O/c8-2-1-3-4(6(10)5(2)9)7(14)12-13-11-3/h1H,(H,11,12,14)
InChIKey NFRLOQWIOYJYOA-UHFFFAOYSA-N
Molecular Weight 250.472 g/mol
SMILES N1C(c2c(N=N1)cc(c(c2Cl)Cl)Cl)=O
SPLASH splash10-05cr-5930000000-4959a1ef0bc79e33d7fb
Source of Spectrum RB-1982-13853-0
Synonyms 5,6,7-Trichloro-3-(hydroxymethyl)-1,2,3-benzotriazin-4(3H)-one
Wiley ID 1251890