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2-(1-Benzyl-1H-1,2,3-triazol-4-yl)-3-(thiophen-2-yl)quinoxaline
SpectraBase Compound ID B0ouDAapunh
InChI InChI=1S/C21H15N5S/c1-2-7-15(8-3-1)13-26-14-18(24-25-26)20-21(19-11-6-12-27-19)23-17-10-5-4-9-16(17)22-20/h1-12,14H,13H2
InChIKey LUMOXNBHIKCMHY-UHFFFAOYSA-N
Mol Weight 369.45 g/mol
Molecular Formula C21H15N5S
Exact Mass 369.104817 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5U80sKZLCOx
Name 2-(1-Benzyl-1H-1,2,3-triazol-4-yl)-3-(thiophen-2-yl)quinoxaline
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H15N5S
InChI InChI=1S/C21H15N5S/c1-2-7-15(8-3-1)13-26-14-18(24-25-26)20-21(19-11-6-12-27-19)23-17-10-5-4-9-16(17)22-20/h1-12,14H,13H2
InChIKey LUMOXNBHIKCMHY-UHFFFAOYSA-N
Ionization Type EI
Literature Reference DOI 10.1002/chem.201900277
Molecular Weight 369.446 g/mol
Quality 231
SMILES C1(=CC=CC=C1)CN1N=NC(=C1)C1=NC2=C(N=C1C=1SC=CC1)C=CC=C2
SPLASH splash10-000f-5097000000-23d2457aa2818e430233
Source of Spectrum QE-25-SM14-3t (DOI: 10.1002/chem.201900277)
Thin-Layer Chromatography 0.10 (petroleum ether/ethyl acetate, 1:1)
Wiley ID 1893786