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Heptafluorobutyric anhydride derivative of paracetamol
SpectraBase Compound ID 1hsFivWPY5I
InChI InChI=1S/C16H7F14NO4/c1-6(32)31(9(33)11(17,18)13(21,22)15(25,26)27)7-2-4-8(5-3-7)35-10(34)12(19,20)14(23,24)16(28,29)30/h2-5H,1H3
InChIKey FHYVJMJZPYAFNV-UHFFFAOYSA-N
Mol Weight 543.21 g/mol
Molecular Formula C16H7F14NO4
Exact Mass 543.015152 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID IphaDgM04mN
Name Heptafluorobutyric anhydride derivative of paracetamol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H7F14NO4
InChI InChI=1S/C16H7F14NO4/c1-6(32)31(9(33)11(17,18)13(21,22)15(25,26)27)7-2-4-8(5-3-7)35-10(34)12(19,20)14(23,24)16(28,29)30/h2-5H,1H3
InChIKey FHYVJMJZPYAFNV-UHFFFAOYSA-N
Molecular Weight 543.213 g/mol
SMILES C(C(C(F)(F)F)(F)F)(C(N(C(=O)C)c1ccc(OC(C(C(C(F)(F)F)(F)F)(F)F)=O)cc1)=O)(F)F
SPLASH splash10-0aor-4902000000-a6f2e2b7e3c16de73167
Source of Spectrum KO-16-184-3
Synonyms 1-Heptafluorobutanoyloxy-4-(n-heptafluorobutanoyl-N-acetylamino)benzene 4-[acetyl(2,2,3,3,4,4,4-heptafluorobutanoyl)amino]phenyl 2,2,3,3,4,4,4-heptafluorobutanoate
Wiley ID 1404917