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5-[(4-chloro-1H-pyrazol-1-yl)methyl]-2-furoic acid
SpectraBase Compound ID 8yq8A0o7vbj
InChI InChI=1S/C9H7ClN2O3/c10-6-3-11-12(4-6)5-7-1-2-8(15-7)9(13)14/h1-4H,5H2,(H,13,14)
InChIKey FTDBLLSABPDLMJ-UHFFFAOYSA-N
Mol Weight 226.62 g/mol
Molecular Formula C9H7ClN2O3
Exact Mass 226.01452 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4hOGMntDJaS
Name 5-[(4-Chloro-1H-pyrazol-1-yl)methyl]-2-furoic acid
Alternate Name(s) 5-[(4-chloranylpyrazol-1-yl)methyl]furan-2-carboxylic acid 5-[(4-chloro-1-pyrazolyl)methyl]-2-furancarboxylic acid 5-[(4-chloropyrazol-1-yl)methyl]-2-furoic acid 5-[(4-chloropyrazol-1-yl)methyl]furan-2-carboxylic acid Furane-2-carboxylic acid, 5-(4-chloro-1-pyrazolylmethyl)-
CAS Registry Number 312309-03-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H7ClN2O3
InChI InChI=1S/C9H7ClN2O3/c10-6-3-11-12(4-6)5-7-1-2-8(15-7)9(13)14/h1-4H,5H2,(H,13,14)
InChIKey FTDBLLSABPDLMJ-UHFFFAOYSA-N
Molecular Weight 226.619 g/mol
SMILES OC(c1oc(C[n]2ncc(c2)Cl)cc1)=O
SPLASH splash10-004i-9610000000-bf3e8db4419911f1dba1
Source of Spectrum AD-0-2532-0
Wiley ID 1433972