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4-Methoxy-3-[(4-methyl-1H-pyrazol-1-yl)methyl]benzoic acid
SpectraBase Compound ID 2oDbW9TVub0
InChI InChI=1S/C13H14N2O3/c1-9-6-14-15(7-9)8-11-5-10(13(16)17)3-4-12(11)18-2/h3-7H,8H2,1-2H3,(H,16,17)
InChIKey DEHJXUCBZZGBSA-UHFFFAOYSA-N
Mol Weight 246.27 g/mol
Molecular Formula C13H14N2O3
Exact Mass 246.100442 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8BIThlXyBeq
Name 4-Methoxy-3-[(4-methyl-1H-pyrazol-1-yl)methyl]benzoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H14N2O3
InChI InChI=1S/C13H14N2O3/c1-9-6-14-15(7-9)8-11-5-10(13(16)17)3-4-12(11)18-2/h3-7H,8H2,1-2H3,(H,16,17)
InChIKey DEHJXUCBZZGBSA-UHFFFAOYSA-N
Molecular Weight 246.266 g/mol
SMILES OC(c1cc(C[n]2ncc(c2)C)c(OC)cc1)=O
SPLASH splash10-0gbj-9210000000-a42e4ed65ec87c73d1b4
Source of Spectrum IY-2-4943-7
Synonyms Benzoic acid, 4-methoxy-3-[(4-methyl-1H-pyrazol-1-yl)methyl]- 4-Methoxy-3-[(4-methyl-1-pyrazolyl)methyl]benzoic acid
Wiley ID 1657420