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5-[(4-chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-2-furoic acid
SpectraBase Compound ID 8oOc0GZkwww
InChI InChI=1S/C11H11ClN2O3/c1-6-10(12)7(2)14(13-6)5-8-3-4-9(17-8)11(15)16/h3-4H,5H2,1-2H3,(H,15,16)
InChIKey CLZYAKOJMOCPJY-UHFFFAOYSA-N
Mol Weight 254.67 g/mol
Molecular Formula C11H11ClN2O3
Exact Mass 254.04582 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9QUVuYhoyLb
Name 5-[(4-Chloro-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-2-furoic acid
CAS Registry Number 312310-61-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H11ClN2O3
InChI InChI=1S/C11H11ClN2O3/c1-6-10(12)7(2)14(13-6)5-8-3-4-9(17-8)11(15)16/h3-4H,5H2,1-2H3,(H,15,16)
InChIKey CLZYAKOJMOCPJY-UHFFFAOYSA-N
Molecular Weight 254.673 g/mol
SMILES OC(c1oc(C[n]2nc(C)c(c2C)Cl)cc1)=O
SPLASH splash10-004i-9820000000-272c5c42f69c2824c54c
Source of Spectrum AD-0-2532-0
Synonyms 5-[(4-chloranyl-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carboxylic acid 5-[(4-chloro-3,5-dimethyl-1-pyrazolyl)methyl]-2-furancarboxylic acid 5-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]-2-furoic acid 5-[(4-chloro-3,5-dimethyl-pyrazol-1-yl)methyl]furan-2-carboxylic acid Furane-2-carboxylic acid, 5-(4-chloro-3,5-dimethyl-1-pyrazolylmethyl)-
Wiley ID 1433971