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4-(1-Benzyl-1H-1,2,3-triazol-5-yl)benzoic acid ethyl ester
SpectraBase Compound ID DEzU9MEGZpW
InChI InChI=1S/C18H17N3O2/c1-2-23-18(22)16-10-8-15(9-11-16)17-12-19-20-21(17)13-14-6-4-3-5-7-14/h3-12H,2,13H2,1H3
InChIKey OJFBJFORELGRKV-UHFFFAOYSA-N
Mol Weight 307.35 g/mol
Molecular Formula C18H17N3O2
Exact Mass 307.132077 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 11csuwRGsr8
Name 4-(1-Benzyl-1H-1,2,3-triazol-5-yl)benzoic acid ethyl ester
Alternate Name(s) Ethyl 4-(1-benzyl-1H-1,2,3-triazol-5-yl)benzoate
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Formula C18H17N3O2
InChI InChI=1S/C18H17N3O2/c1-2-23-18(22)16-10-8-15(9-11-16)17-12-19-20-21(17)13-14-6-4-3-5-7-14/h3-12H,2,13H2,1H3
InChIKey OJFBJFORELGRKV-UHFFFAOYSA-N
Literature Reference DOI 10.1021/ol9020354
Molecular Weight 307.353 g/mol
SMILES C([n]1c(-c2ccc(C(=O)OCC)cc2)cnn1)c1ccccc1
SPLASH splash10-0006-9332000000-0e390f3830afa5a1f36f
Source of Spectrum A1-11-4922/SMS16-3s
Wiley ID 1760128