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5-Methyl-3-[4-(trifluoromethyl)phenyl]-2-isoxazoline-5-carboxylic acid
SpectraBase Compound ID 6CjV1YJ5Ufw
InChI InChI=1S/C12H10F3NO3/c1-11(10(17)18)6-9(16-19-11)7-2-4-8(5-3-7)12(13,14)15/h2-5H,6H2,1H3,(H,17,18)
InChIKey WVAPSFQKIJBMEF-UHFFFAOYSA-N
Mol Weight 273.21 g/mol
Molecular Formula C12H10F3NO3
Exact Mass 273.061278 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3kHxpJq77lv
Name 5-Methyl-3-[4-(trifluoromethyl)phenyl]-2-isoxazoline-5-carboxylic acid
Alternate Name(s) 5-Methyl-3-[4-(trifluoromethyl)phenyl]-4H-1,2-oxazole-5-carboxylic acid 5-Methyl-3-[4-(trifluoromethyl)phenyl]-4H-isoxazole-5-carboxylic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H10F3NO3
InChI InChI=1S/C12H10F3NO3/c1-11(10(17)18)6-9(16-19-11)7-2-4-8(5-3-7)12(13,14)15/h2-5H,6H2,1H3,(H,17,18)
InChIKey WVAPSFQKIJBMEF-UHFFFAOYSA-N
Molecular Weight 273.211 g/mol
SMILES OC(C1(ON=C(C1)c1ccc(cc1)C(F)(F)F)C)=O
SPLASH splash10-002r-0960000000-b82a8ce6d80744beed38
Source of Spectrum AJ-43-512-2
Wiley ID 1593977