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2,2,2-trifluoro-N-(2-(3-hydroxyprop-1-ynyl)-4,6-dimethylphenyl)acetamide
SpectraBase Compound ID Af9V6hNebzt
InChI InChI=1S/C13H12F3NO2/c1-8-6-9(2)11(10(7-8)4-3-5-18)17-12(19)13(14,15)16/h6-7,18H,5H2,1-2H3,(H,17,19)
InChIKey PMHGIAPVYYZJTN-UHFFFAOYSA-N
Mol Weight 271.24 g/mol
Molecular Formula C13H12F3NO2
Exact Mass 271.082013 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 737Lqc4sBTy
Name 2,2,2-trifluoro-N-(2-(3-hydroxyprop-1-ynyl)-4,6-dimethylphenyl)acetamide
Alternate Name(s) 2,2,2-trifluoro-N-(2-(3-hydroxyprop-1-yn-1-yl)-4,6-dimethylphenyl)acetamide
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H12F3NO2
InChI InChI=1S/C13H12F3NO2/c1-8-6-9(2)11(10(7-8)4-3-5-18)17-12(19)13(14,15)16/h6-7,18H,5H2,1-2H3,(H,17,19)
InChIKey PMHGIAPVYYZJTN-UHFFFAOYSA-N
Literature Reference DOI 10.1002/adsc.201400881
Molecular Weight 271.239 g/mol
SMILES N(c1c(C#CCO)cc(cc1C)C)C(=O)C(F)(F)F
SPLASH splash10-0aor-9030000000-503898df900976fc2967
Source of Spectrum ASC-357-1053/SM4-1b
Wiley ID 1770987