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3-[1-p-Nitrophenyl-3-ethoxycarbonyl-5-methyl-1H-pyrazole-4-carbonyl]-7-phenyl-pyrazolo[5,1-c][1,2,4]triazine
SpectraBase Compound ID I1LMS2Ws9Vk
InChI InChI=1S/C25H19N7O5/c1-3-37-25(34)23-22(15(2)31(29-23)17-9-11-18(12-10-17)32(35)36)24(33)20-14-30-21(27-26-20)13-19(28-30)16-7-5-4-6-8-16/h4-14H,3H2,1-2H3
InChIKey RYLSLRBBMCHHGH-UHFFFAOYSA-N
Mol Weight 497.47 g/mol
Molecular Formula C25H19N7O5
Exact Mass 497.144767 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 45081R1Oo8q
Name 3-[1-p-Nitrophenyl-3-ethoxycarbonyl-5-methyl-1H-pyrazole-4-carbonyl]-7-phenyl-pyrazolo[5,1-c][1,2,4]triazine
Appearance Yellow solid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H19N7O5
InChI InChI=1S/C25H19N7O5/c1-3-37-25(34)23-22(15(2)31(29-23)17-9-11-18(12-10-17)32(35)36)24(33)20-14-30-21(27-26-20)13-19(28-30)16-7-5-4-6-8-16/h4-14H,3H2,1-2H3
InChIKey RYLSLRBBMCHHGH-UHFFFAOYSA-N
Instrument Name GC??MS QP1000 EX Shimadzu
Ionization Type EI
Literature Reference DOI 10.1002/jhet.3415
Molecular Weight 497.471 g/mol
SMILES c1(n[n](c(c1C(=O)C=1N=Nc2[n](C1)nc(c2)-c1ccccc1)C)-c1ccc(cc1)[N+]([O-])=O)C(OCC)=O
SPLASH splash10-03mi-4192000000-e80f2a6fa32e9dd7260b
Source of Spectrum Y-56-430-8e
Wiley ID 1859377