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3H-Pyrazole-3,3-dicarboxylic acid, 4,5-dihydro-4-(1-methylethyl)-, dimethyl ester
SpectraBase Compound ID JK8smj62aGo
InChI InChI=1S/C10H16N2O4/c1-6(2)7-5-11-12-10(7,8(13)15-3)9(14)16-4/h6-7H,5H2,1-4H3
InChIKey XLOUOHRYAIHCJS-UHFFFAOYSA-N
Mol Weight 228.25 g/mol
Molecular Formula C10H16N2O4
Exact Mass 228.111007 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4x5FP3VRzd1
Name Dimethyl 4-isopropyl-4,5-dihydro-3H-pyrazole-3,3-dicarboxylate
CAS Registry Number 33304-81-3
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H16N2O4
InChI InChI=1S/C10H16N2O4/c1-6(2)7-5-11-12-10(7,8(13)15-3)9(14)16-4/h6-7H,5H2,1-4H3
InChIKey XLOUOHRYAIHCJS-UHFFFAOYSA-N
Molecular Weight 228.248 g/mol
SMILES C1(N=NCC1C(C)C)(C(=O)OC)C(=O)OC
SPLASH splash10-004m-9500000000-0959ffe8efee9e2ddfe0
Source of Spectrum HE-1982-0-0
Synonyms 3H-Pyrazole-3,3-dicarboxylic acid, 4,5-dihydro-4-(1-methylethyl)-, dimethyl ester 4-isopropyl-1-pyrazoline-3,3-dicarboxylic acid dimethyl ester 4-Propan-2-yl-3,4-dihydropyrazole-5,5-dicarboxylic acid dimethyl ester Dimethyl 4-isopropyl-3,4-dihydropyrazole-5,5-dicarboxylate Dimethyl 4-propan-2-yl-3,4-dihydropyrazole-5,5-dicarboxylate
Wiley ID 1229272