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3-(1-Phenyl-3-ethoxycarbonyl-5-methyl-1H-pyrazole-4-carbonyl)[1,2,4]triazolo[5,1-c][1,2,4]triazine
SpectraBase Compound ID 7BQRbmsFxkL
InChI InChI=1S/C18H15N7O3/c1-3-28-17(27)15-14(11(2)25(23-15)12-7-5-4-6-8-12)16(26)13-9-24-18(22-21-13)19-10-20-24/h4-10H,3H2,1-2H3
InChIKey ZLMZYCIRVPAUBB-UHFFFAOYSA-N
Mol Weight 377.36 g/mol
Molecular Formula C18H15N7O3
Exact Mass 377.123637 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IxVkxGblCZU
Name 3-(1-Phenyl-3-ethoxycarbonyl-5-methyl-1H-pyrazole-4-carbonyl)[1,2,4]triazolo[5,1-c][1,2,4]triazine
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H15N7O3
InChI InChI=1S/C18H15N7O3/c1-3-28-17(27)15-14(11(2)25(23-15)12-7-5-4-6-8-12)16(26)13-9-24-18(22-21-13)19-10-20-24/h4-10H,3H2,1-2H3
InChIKey ZLMZYCIRVPAUBB-UHFFFAOYSA-N
Instrument Name GC??MS QP1000 EX Shimadzu
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3415
Molecular Weight 377.364 g/mol
SMILES c1(n[n](c(c1C(=O)C=1N=Nc2[n](C1)ncn2)C)-c1ccccc1)C(OCC)=O
SPLASH splash10-0aor-9403000000-2cfd4c91a986f2cc18dd
Source of Spectrum Y-56-429-6c
Wiley ID 1859366