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N-(2,4-dimethylphenyl)-2,2,2-trifluoro-N-(2,2,2-trifluoroacetyl)acetamide
SpectraBase Compound ID HljlS6im1gD
InChI InChI=1S/C12H9F6NO2/c1-6-3-4-8(7(2)5-6)19(9(20)11(13,14)15)10(21)12(16,17)18/h3-5H,1-2H3
InChIKey ZMKPJMHBMWHKEG-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 2gU94bItIdl
Name N-(2,4-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/c1-6-3-4-8(7(2)5-6)19(9(20)11(13,14)15)10(21)12(16,17)18/h3-5H,1-2H3
InChIKey ZMKPJMHBMWHKEG-UHFFFAOYSA-N
Instrument Name MS-80
Ionization Type EI
Literature Reference DOI 10.1002/jhrc.1240170608
Molecular Weight 313.199 g/mol
Quality 489
SMILES C1=C(N(C(C(F)(F)F)=O)C(C(F)(F)F)=O)C(C)=CC(=C1)C
SPLASH splash10-014i-9823000000-b405bb7811a6048eadc8
Source of Spectrum HRC-17-422-Figure 3b (DOI: 10.1002/jhrc.1240170608)
Wiley ID 1910838