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3-(3-amino-2-pyrazolin-1-yl)benzoic acid

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3-(3-amino-2-pyrazolin-1-yl)benzoic acid
SpectraBase Compound ID 1Hm2ZN3Htya
InChI InChI=1S/C10H11N3O2/c11-9-4-5-13(12-9)8-3-1-2-7(6-8)10(14)15/h1-3,6H,4-5H2,(H2,11,12)(H,14,15)
InChIKey GDIDLJVTFAHRJS-UHFFFAOYSA-N
Mol Weight 205.22 g/mol
Molecular Formula C10H11N3O2
Exact Mass 205.085127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CyBKG91JhuF
Name 3-(3-amino-2-pyrazolin-1-yl)benzoic acid
Alternate Name(s) 3-(3-Imino-1-pyrazolidinyl)benzoic acid 3-(5-amino-3,4-dihydropyrazol-2-yl)benzoic acid 3-(5-azanyl-3,4-dihydropyrazol-2-yl)benzoic acid
CAS Registry Number 83671-99-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H11N3O2
InChI InChI=1S/C10H11N3O2/c11-9-4-5-13(12-9)8-3-1-2-7(6-8)10(14)15/h1-3,6H,4-5H2,(H2,11,12)(H,14,15)
InChIKey GDIDLJVTFAHRJS-UHFFFAOYSA-N
Molecular Weight 205.217 g/mol
SMILES N1N(CCC1=N)c1cc(ccc1)C(=O)O
SPLASH splash10-0pb9-9110000000-d98419faffd24b0ffd8b
Wiley ID 1470453