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Benzoic acid, 4-(5-butoxy-6-methyl-2H-benzotriazol-2-yl)-, methyl ester
SpectraBase Compound ID Hh5x0UoDsjI
InChI InChI=1S/C19H21N3O3/c1-4-5-10-25-18-12-17-16(11-13(18)2)20-22(21-17)15-8-6-14(7-9-15)19(23)24-3/h6-9,11-12H,4-5,10H2,1-3H3
InChIKey DEWXMVYMHUBKHC-UHFFFAOYSA-N
Mol Weight 339.4 g/mol
Molecular Formula C19H21N3O3
Exact Mass 339.158292 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HrXglnTBt1X
Name Benzoic acid, 4-(5-butoxy-6-methyl-2H-benzotriazol-2-yl)-, methyl ester
CAS Registry Number 100514-17-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H21N3O3
InChI InChI=1S/C19H21N3O3/c1-4-5-10-25-18-12-17-16(11-13(18)2)20-22(21-17)15-8-6-14(7-9-15)19(23)24-3/h6-9,11-12H,4-5,10H2,1-3H3
InChIKey DEWXMVYMHUBKHC-UHFFFAOYSA-N
Molecular Weight 339.395 g/mol
SMILES c12n[n](nc1cc(c(c2)OCCCC)C)-c1ccc(C(=O)OC)cc1
SPLASH splash10-001i-1093000000-54ba0df1e85feda825b5
Source of Spectrum K-119-1637-0
Synonyms Methyl 4-(5-butoxy-6-methyl-2H-1,2,3-benzotriazol-2-yl)benzoate Methyl 4-(5-butoxy-6-methyl-2H-benzotriazol-2-yl)benzoate
Wiley ID 1334508