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Di-i-propyl 5-Amino-1-(m-nitrophenyl)pyrazole-3,4-dicarboxylate
SpectraBase Compound ID 1KE5XrStCY9
InChI InChI=1S/C17H20N4O6/c1-9(2)26-16(22)13-14(17(23)27-10(3)4)19-20(15(13)18)11-6-5-7-12(8-11)21(24)25/h5-10H,18H2,1-4H3
InChIKey LDTIPWBQQVMDLX-UHFFFAOYSA-N
Mol Weight 376.37 g/mol
Molecular Formula C17H20N4O6
Exact Mass 376.138284 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5LoUC5Zhmag
Name Di-i-propyl 5-Amino-1-(m-nitrophenyl)pyrazole-3,4-dicarboxylate
Alternate Name(s) diisopropyl 5-amino-1-(3-nitrophenyl)-1H-pyrazole-3,4-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H20N4O6
InChI InChI=1S/C17H20N4O6/c1-9(2)26-16(22)13-14(17(23)27-10(3)4)19-20(15(13)18)11-6-5-7-12(8-11)21(24)25/h5-10H,18H2,1-4H3
InChIKey LDTIPWBQQVMDLX-UHFFFAOYSA-N
Molecular Weight 376.369 g/mol
SMILES Nc1c(c(n[n]1-c1cc(N(=O)=O)ccc1)C(OC(C)C)=O)C(OC(C)C)=O
SPLASH splash10-00dl-0093000000-2e6d5c6d7b38e1a8639d
Source of Spectrum H1-48-2101-5
Wiley ID 816664