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5-(N-[3-Chloro-phthalimido]-isopropylamino)-3-methyl-4-pyrazolecarboxylic acid, methyl ester

View entire compound with spectra: 1 NMR

5-(N-[3-Chloro-phthalimido]-isopropylamino)-3-methyl-4-pyrazolecarboxylic acid, methyl ester
SpectraBase Compound ID G7l0r4ZkAXg
InChI InChI=1S/C17H17ClN4O4/c1-8(2)21(14-12(17(25)26-4)9(3)19-20-14)22-15(23)10-6-5-7-11(18)13(10)16(22)24/h5-8H,1-4H3,(H,19,20)
InChIKey OXNBBKOIDYUCEE-UHFFFAOYSA-N
Mol Weight 376.8 g/mol
Molecular Formula C17H17ClN4O4
Exact Mass 376.093833 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D65eSLK7pKa
Name 5-(N-[3-Chloro-phthalimido]-isopropylamino)-3-methyl-4-pyrazolecarboxylic acid, methyl ester
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Formula C17H17ClN4O4
InChI InChI=1S/C17H17ClN4O4/c1-8(2)21(14-12(17(25)26-4)9(3)19-20-14)22-15(23)10-6-5-7-11(18)13(10)16(22)24/h5-8H,1-4H3,(H,19,20)
InChIKey OXNBBKOIDYUCEE-UHFFFAOYSA-N
Instrument Name Bruker AM-270
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent DMSO-D6