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Benzoic acid, 4-(4-chloro-1-pyrazolylmethyl)-
SpectraBase Compound ID B9swI0lo1Wa
InChI InChI=1S/C11H9ClN2O2/c12-10-5-13-14(7-10)6-8-1-3-9(4-2-8)11(15)16/h1-5,7H,6H2,(H,15,16)
InChIKey UGZUJTGYNFLQEC-UHFFFAOYSA-N
Mol Weight 236.66 g/mol
Molecular Formula C11H9ClN2O2
Exact Mass 236.035255 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9nTMqPatDJG
Name Benzoic acid, 4-(4-chloro-1-pyrazolylmethyl)-
Alternate Name(s) 4-[(4-chloranylpyrazol-1-yl)methyl]benzoic acid 4-[(4-chloro-1-pyrazolyl)methyl]benzoic acid 4-[(4-Chloro-1H-pyrazol-1-yl)methyl]benzoic acid 4-[(4-chloropyrazol-1-yl)methyl]benzoic acid
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Formula C11H9ClN2O2
InChI InChI=1S/C11H9ClN2O2/c12-10-5-13-14(7-10)6-8-1-3-9(4-2-8)11(15)16/h1-5,7H,6H2,(H,15,16)
InChIKey UGZUJTGYNFLQEC-UHFFFAOYSA-N
Molecular Weight 236.658 g/mol
SMILES OC(c1ccc(C[n]2ncc(c2)Cl)cc1)=O
SPLASH splash10-000i-8970000000-2679581dff787983cb3a
Source of Spectrum AD-0-2532-0
Wiley ID 1433943