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{2-[(3,5-dimethyl-4-isoxazolyl)carbonyl]phenyl}acetic acid
SpectraBase Compound ID 6pPXsQVEomO
InChI InChI=1S/C14H13NO4/c1-8-13(9(2)19-15-8)14(18)11-6-4-3-5-10(11)7-12(16)17/h3-6H,7H2,1-2H3,(H,16,17)
InChIKey PCUWOEIKPYDOLB-UHFFFAOYSA-N
Mol Weight 259.26 g/mol
Molecular Formula C14H13NO4
Exact Mass 259.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GnwhjgyGQ4A
Name {2-[(3,5-dimethyl-4-isoxazolyl)carbonyl]phenyl}acetic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H13NO4
InChI InChI=1S/C14H13NO4/c1-8-13(9(2)19-15-8)14(18)11-6-4-3-5-10(11)7-12(16)17/h3-6H,7H2,1-2H3,(H,16,17)
InChIKey PCUWOEIKPYDOLB-UHFFFAOYSA-N
Molecular Weight 259.261 g/mol
SMILES OC(Cc1c(C(c2c(onc2C)C)=O)cccc1)=O
SPLASH splash10-0f6x-9070000000-cad662c9ce2518d0e6ec
Source of Spectrum Y4-84-331-9
Synonyms 2-[2-[(3,5-dimethyl-4-isoxazolyl)-oxomethyl]phenyl]acetic acid 2-[2-(3,5-dimethyl-1,2-oxazole-4-carbonyl)phenyl]acetic acid 2-[2-[(3,5-dimethyl-1,2-oxazol-4-yl)carbonyl]phenyl]ethanoic acid
Wiley ID 1550128