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methyl 2-(5-bromo-2H-benzo[d][1,2,3]triazol-2-yl)-2-phenylacetate
SpectraBase Compound ID FOWpgiGEote
InChI InChI=1S/C15H12BrN3O2/c1-21-15(20)14(10-5-3-2-4-6-10)19-17-12-8-7-11(16)9-13(12)18-19/h2-9,14H,1H3
InChIKey MPXNWUPFGLSNPM-UHFFFAOYSA-N
Mol Weight 346.18 g/mol
Molecular Formula C15H12BrN3O2
Exact Mass 345.01129 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D8exZkCgyD2
Name methyl 2-(5-bromo-2H-benzo[d][1,2,3]triazol-2-yl)-2-phenylacetate
Appearance White solid
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Exact Mass 345.011289636 u
Formula C15H12BrN3O2
InChI InChI=1S/C15H12BrN3O2/c1-21-15(20)14(10-5-3-2-4-6-10)19-17-12-8-7-11(16)9-13(12)18-19/h2-9,14H,1H3
InChIKey MPXNWUPFGLSNPM-UHFFFAOYSA-N
Instrument Name Agilent 7890B-5977B
Ionization Type EI
Literature Reference DOI 10.1002/anie.201807039
Molecular Weight 346.184 g/mol
Quality 850
Reported Formula C15H12BrN3O2
SMILES COC(C(C1=CC=CC=C1)N1N=C2C(=N1)C=C(C=C2)Br)=O
SPLASH splash10-002r-4982000000-191e230b963fbafaf832
Source of Spectrum ACI-57-SM167-3p (DOI: 10.1002/anie.201807039)
Wiley ID 1896826