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1-(2-methyl-5-((5-methyl-2H-benzo[d][1,2,3]triazol-2-yl)(phenyl)methyl)furan-3-yl)ethan-1-one
SpectraBase Compound ID DIq7bPL0Iaf
InChI InChI=1S/C21H19N3O2/c1-13-9-10-18-19(11-13)23-24(22-18)21(16-7-5-4-6-8-16)20-12-17(14(2)25)15(3)26-20/h4-12,21H,1-3H3
InChIKey PUOYTVLBFQTSPY-UHFFFAOYSA-N
Mol Weight 345.4 g/mol
Molecular Formula C21H19N3O2
Exact Mass 345.147727 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KucbDIsoVLF
Name 1-(2-methyl-5-((5-methyl-2H-benzo[d][1,2,3]triazol-2-yl)(phenyl)methyl)furan-3-yl)ethan-1-one
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 345.147726862 u
Formula C21H19N3O2
InChI InChI=1S/C21H19N3O2/c1-13-9-10-18-19(11-13)23-24(22-18)21(16-7-5-4-6-8-16)20-12-17(14(2)25)15(3)26-20/h4-12,21H,1-3H3
InChIKey PUOYTVLBFQTSPY-UHFFFAOYSA-N
Instrument Name Agilent 7890B-5977B
Ionization Type EI
Literature Reference DOI 10.1002/anie.201807039
Molecular Weight 345.402 g/mol
Quality 368
Reported Formula C21H19N3O2
SMILES CC=1OC(=CC1C(C)=O)C(C1=CC=CC=C1)N1N=C2C(=N1)C=C(C=C2)C
SPLASH splash10-03di-0390000000-49d26016100e4cda61af
Source of Spectrum ACI-57-SM180-6j (DOI: 10.1002/anie.201807039)
Wiley ID 1896839