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Paracetamol 2TFA
SpectraBase Compound ID GdOO5eOKk7k
InChI InChI=1S/C12H7F6NO4/c1-6(20)19(9(21)11(13,14)15)7-2-4-8(5-3-7)23-10(22)12(16,17)18/h2-5H,1H3
InChIKey DEPPWJVMLMVMDO-UHFFFAOYSA-N
Mol Weight 343.18 g/mol
Molecular Formula C12H7F6NO4
Exact Mass 343.027927 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GYmevXBWwka
Name Paracetamol 2TFA
Classification Pharmaceutical drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
Exact Mass 343.027926683 u
Formula C12H7F6NO4
InChI InChI=1S/C12H7F6NO4/c1-6(20)19(9(21)11(13,14)15)7-2-4-8(5-3-7)23-10(22)12(16,17)18/h2-5H,1H3
InChIKey DEPPWJVMLMVMDO-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 343.181 g/mol
Nominal Mass 343 u
Quality 996
Retention Index 2454
SMILES C=1(N(C(C(F)(F)F)=O)C(=O)C)C=CC(OC(C(F)(F)F)=O)=CC1
SPLASH splash10-0f6x-9223000000-e83c9ce0e4b9b506d566
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 4-(acetyl(trifluoroacetyl)amino)phenyl trifluoroacetate
Technique GC/MS
Wiley ID DD2024_034749