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3-(5-Trifluoromethylisoxazol-3-yl)propanoic acid
SpectraBase Compound ID HMRZX4JsEA2
InChI InChI=1S/C7H6F3NO3/c8-7(9,10)5-3-4(11-14-5)1-2-6(12)13/h3H,1-2H2,(H,12,13)
InChIKey ADDVCIDPOHVEHH-UHFFFAOYSA-N
Mol Weight 209.12 g/mol
Molecular Formula C7H6F3NO3
Exact Mass 209.029978 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Bl1jQ54pLPu
Name 3-(5-Trifluoromethylisoxazol-3-yl)propanoic acid
Alternate Name(s) 3-(5-(trifluoromethyl)isoxazol-3-yl)propanoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H6F3NO3
InChI InChI=1S/C7H6F3NO3/c8-7(9,10)5-3-4(11-14-5)1-2-6(12)13/h3H,1-2H2,(H,12,13)
InChIKey ADDVCIDPOHVEHH-UHFFFAOYSA-N
Molecular Weight 209.124 g/mol
SMILES OC(CCc1cc(C(F)(F)F)on1)=O
SPLASH splash10-014l-9200000000-943f90a8a81fd90210d3
Source of Spectrum Y-51-737-5a
Wiley ID 1741343