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N-(2,3-dimethylphenyl)-2,2,2-trifluoro-N-(2,2,2-trifluoroacetyl)acetamide
SpectraBase Compound ID 7dpHu44uaLj
InChI InChI=1S/C12H9F6NO2/c1-6-4-3-5-8(7(6)2)19(9(20)11(13,14)15)10(21)12(16,17)18/h3-5H,1-2H3
InChIKey PJQJMQIDZHIKRZ-UHFFFAOYSA-N
Mol Weight 313.2 g/mol
Molecular Formula C12H9F6NO2
Exact Mass 313.053748 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6jmreB4GGK2
Name N-(2,3-dimethylphenyl)-2,2,2-trifluoro-N-(2,2,2-trifluoroacetyl)acetamide
Carrier Gas Helium (1 mL/min)
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 313.053747510 u
Formula C12H9F6NO2
GC Column RTX-1 (105 m x 0.25 mm, film thickness 0.5 micrometer)
GC Oven Program Oven temp 320 oC
InChI InChI=1S/C12H9F6NO2/c1-6-4-3-5-8(7(6)2)19(9(20)11(13,14)15)10(21)12(16,17)18/h3-5H,1-2H3
InChIKey PJQJMQIDZHIKRZ-UHFFFAOYSA-N
Instrument Name MS-80
Ionization Type EI
Literature Reference DOI 10.1002/jhrc.1240170608
Molecular Weight 313.199 g/mol
Quality 467
SMILES C1=C(N(C(C(F)(F)F)=O)C(C(F)(F)F)=O)C(C)=C(C)C=C1
SPLASH splash10-014i-9521000000-63ca966d8ef6c7a5e57a
Source of Spectrum HRC-17-422-Figure 3a (DOI: 10.1002/jhrc.1240170608)
Wiley ID 1910837