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5-AMINO-1,4-DIETHOXYCARBONYLPYRAZOLE
SpectraBase Compound ID 23DkBXtTYyJ
InChI InChI=1S/C9H13N3O4/c1-3-15-8(13)6-5-11-12(7(6)10)9(14)16-4-2/h5H,3-4,10H2,1-2H3
InChIKey IXDAMGOOPXGHDW-UHFFFAOYSA-N
Mol Weight 227.22 g/mol
Molecular Formula C9H13N3O4
Exact Mass 227.090606 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GcYBrSTycqe
Name Diethyl 5-amino-1H-pyrazole-1,4-dicarboxylate
CAS Registry Number 220131-60-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13N3O4
InChI InChI=1S/C9H13N3O4/c1-3-15-8(13)6-5-11-12(7(6)10)9(14)16-4-2/h5H,3-4,10H2,1-2H3
InChIKey IXDAMGOOPXGHDW-UHFFFAOYSA-N
Molecular Weight 227.220 g/mol
SMILES Nc1[n](ncc1C(=O)OCC)C(=O)OCC
SPLASH splash10-0a4i-3910000000-93662f2e73fe00df9b40
Source of Spectrum AD-0-2532-0
Synonyms 5-Aminopyrazole-1,4-dicarboxylic acid diethyl ester Diethyl 5-aminopyrazole-1,4-dicarboxylate Diethyl 5-azanylpyrazole-1,4-dicarboxylate Pyrazole-1,4-dicarboxylic acid, 5-amino-, diethyl ester
Wiley ID 1432252