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Propanoic acid, pentafluoro-, 4-[2-[acetyl(2,2,3,3,3-pentafluoro-1-oxopropyl)amino]propyl]phenyl ester, (.+-.)-
SpectraBase Compound ID 63QSFEXWNhY
InChI InChI=1S/C17H13F10NO4/c1-8(28(9(2)29)12(30)14(18,19)16(22,23)24)7-10-3-5-11(6-4-10)32-13(31)15(20,21)17(25,26)27/h3-6,8H,7H2,1-2H3
InChIKey BBWJVDHYHMUUMP-UHFFFAOYSA-N
Mol Weight 485.28 g/mol
Molecular Formula C17H13F10NO4
Exact Mass 485.06849 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7TVUehEulMW
Name Propanoic acid, pentafluoro-, 4-[2-[acetyl(2,2,3,3,3-pentafluoro-1-oxopropyl)amino]propyl]phenyl ester, (.+-.)-
Alternate Name(s) 2-(p-pentafluoroethylcarbonyloxyphenyl)-N-pentafluoroethylcarbonyl-1-methyl-N-acetyl-ethylamine 4-{2-[acetyl(2,2,3,3,3-pentafluoropropanoyl)amino]propyl}phenyl 2,2,3,3,3-pentafluoropropanoate
CAS Registry Number 93667-21-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H13F10NO4
InChI InChI=1S/C17H13F10NO4/c1-8(28(9(2)29)12(30)14(18,19)16(22,23)24)7-10-3-5-11(6-4-10)32-13(31)15(20,21)17(25,26)27/h3-6,8H,7H2,1-2H3
InChIKey BBWJVDHYHMUUMP-UHFFFAOYSA-N
Molecular Weight 485.278 g/mol
SMILES C(C(N(C(Cc1ccc(OC(C(C(F)(F)F)(F)F)=O)cc1)C)C(=O)C)=O)(C(F)(F)F)(F)F
SPLASH splash10-00lr-3290000000-52195118502046d22cb3
Source of Spectrum KO-11-444-11
Wiley ID 1396231