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(5-Methyl-1-phenyl-1H-1,2,3-triazol-4-yl)(3-(thiophene-2-carbonyl)isoxazol-4-yl)methanone
SpectraBase Compound ID 2yvGLi0YZf3
InChI InChI=1S/C18H12N4O3S/c1-11-15(19-21-22(11)12-6-3-2-4-7-12)17(23)13-10-25-20-16(13)18(24)14-8-5-9-26-14/h2-10H,1H3
InChIKey NQCYZTLBKIRGEP-UHFFFAOYSA-N
Mol Weight 364.38 g/mol
Molecular Formula C18H12N4O3S
Exact Mass 364.063011 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EvruoEIb2CM
Name (5-Methyl-1-phenyl-1H-1,2,3-triazol-4-yl)(3-(thiophene-2-carbonyl)isoxazol-4-yl)methanone
Appearance Gray solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H12N4O3S
InChI InChI=1S/C18H12N4O3S/c1-11-15(19-21-22(11)12-6-3-2-4-7-12)17(23)13-10-25-20-16(13)18(24)14-8-5-9-26-14/h2-10H,1H3
InChIKey NQCYZTLBKIRGEP-UHFFFAOYSA-N
Instrument Name Shimadzu GC-MS QP1000 EX
Ionization Type EI
Literature Reference DOI 10.1002/jhet.2343
Molecular Weight 364.379 g/mol
SMILES Cc1c(nn[n]1-c1ccccc1)C(=O)c1c(noc1)C(=O)c1sccc1
SPLASH splash10-03di-3900000000-df9bc258f366993662db
Source of Spectrum Y-53-715-13c
Wiley ID 1877695