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1H-Pyrazole-1-butanoic acid, 3-amino-5-methyl-, methyl ester
SpectraBase Compound ID JJzVCZY6kXO
InChI InChI=1S/C9H15N3O2/c1-7-6-8(10)11-12(7)5-3-4-9(13)14-2/h6H,3-5H2,1-2H3,(H2,10,11)
InChIKey STHLLZYRFMFLTM-UHFFFAOYSA-N
Mol Weight 197.24 g/mol
Molecular Formula C9H15N3O2
Exact Mass 197.116427 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BJRXqUHidw6
Name 1H-Pyrazole-1-butanoic acid, 3-amino-5-methyl-, methyl ester
Alternate Name(s) 4-(3-amino-5-methyl-1-pyrazolyl)butanoic acid methyl ester Methyl 4-(3-amino-5-methylpyrazol-1-yl)butanoate Methyl 4-(3-amino-5-methyl-pyrazol-1-yl)butanoate Methyl 4-(3-azanyl-5-methyl-pyrazol-1-yl)butanoate
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Formula C9H15N3O2
InChI InChI=1S/C9H15N3O2/c1-7-6-8(10)11-12(7)5-3-4-9(13)14-2/h6H,3-5H2,1-2H3,(H2,10,11)
InChIKey STHLLZYRFMFLTM-UHFFFAOYSA-N
Molecular Weight 197.238 g/mol
SMILES Nc1n[n](c(c1)C)CCCC(OC)=O
SPLASH splash10-03dj-9800000000-79a23270cd5a48734f39
Source of Spectrum IY-1-4395-9
Wiley ID 1651942