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METHYL-4-(4-CARBOXYPHENYL)-6-METHYL-4,7-DIHYDRO-1H-PYRAZOLO-[3,4-B]-PYRIDINE-5-CARBOXYLATE
SpectraBase Compound ID Aup9hf50Ke7
InChI InChI=1S/C16H15N3O4/c1-8-12(16(22)23-2)13(11-7-17-19-14(11)18-8)9-3-5-10(6-4-9)15(20)21/h3-7,13H,1-2H3,(H,20,21)(H2,17,18,19)
InChIKey KUUYKXBADRZWSK-UHFFFAOYSA-N
Mol Weight 313.31 g/mol
Molecular Formula C16H15N3O4
Exact Mass 313.106256 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DXL8sZyaLp9
Name Methyl 6-methyl-4-(2-carboxyphenyl)-4,7-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate
Alternate Name(s) 2-[5-(methoxycarbonyl)-6-methyl-4,7-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl]benzoic acid Methyl 6-methyl-4-(4-carboxyphenyl)-4,7-dihydro-1H-pyrazolo[3,4-b]pyridine-5-carboxylate 4-(5-Methoxycarbonyl-6-methyl-2,4-dihydro-1H-pyrazolo[3,4-b]pyridin-4-yl)benzoic acid
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Formula C16H15N3O4
InChI InChI=1S/C16H15N3O4/c1-8-12(16(22)23-2)13(11-7-17-19-14(11)18-8)9-3-5-10(6-4-9)15(20)21/h3-7,13H,1-2H3,(H,20,21)(H2,17,18,19)
InChIKey KUUYKXBADRZWSK-UHFFFAOYSA-N
Molecular Weight 313.313 g/mol
SMILES [nH]1ncc2C(c3ccc(C(=O)O)cc3)C(=C(Nc12)C)C(=O)OC
SPLASH splash10-08fr-1970000000-a11798421eaf54573184
Source of Spectrum KC-0-950-3
Wiley ID 785597