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4-(4-keto-1,2,3-benzotriazin-3-yl)butyric acid
SpectraBase Compound ID 9JqW3mqHY4G
InChI InChI=1S/C11H11N3O3/c15-10(16)6-3-7-14-11(17)8-4-1-2-5-9(8)12-13-14/h1-2,4-5H,3,6-7H2,(H,15,16)
InChIKey UFCNOKFGMNKFMO-UHFFFAOYSA-N
Mol Weight 233.23 g/mol
Molecular Formula C11H11N3O3
Exact Mass 233.080041 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DTs3KAS00eh
Name 4-(4-keto-1,2,3-benzotriazin-3-yl)butyric acid
CAS Registry Number 97609-03-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11N3O3
InChI InChI=1S/C11H11N3O3/c15-10(16)6-3-7-14-11(17)8-4-1-2-5-9(8)12-13-14/h1-2,4-5H,3,6-7H2,(H,15,16)
InChIKey UFCNOKFGMNKFMO-UHFFFAOYSA-N
Molecular Weight 233.227 g/mol
SMILES OC(CCCN1C(=O)c2c(N=N1)cccc2)=O
SPLASH splash10-0mry-3900000000-bcdd60b01990b350c05c
Source of Spectrum O-20-187-9
Synonyms 4-(4-oxidanylidene-1,2,3-benzotriazin-3-yl)butanoic acid 4-(4-oxo-1,2,3-benzotriazin-3(4H)-yl)butanoic acid 4-(4-oxo-1,2,3-benzotriazin-3-yl)butanoic acid
Wiley ID 1234716