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Acetic acid, trifluoro-, 1-[4-(acetyloxy)-3-methoxyphenyl]-2-[acetyl(trifluoroacetyl)amino]ethyl ester, (.+-.)-
SpectraBase Compound ID KvHBEuZ4DmT
InChI InChI=1S/C17H15F6NO7/c1-8(25)24(14(27)16(18,19)20)7-13(31-15(28)17(21,22)23)10-4-5-11(30-9(2)26)12(6-10)29-3/h4-6,13H,7H2,1-3H3
InChIKey KKWIMJGJKIFOLR-UHFFFAOYSA-N
Mol Weight 459.3 g/mol
Molecular Formula C17H15F6NO7
Exact Mass 459.075271 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KjdqsoIM2mC
Name Acetic acid, trifluoro-, 1-[4-(acetyloxy)-3-methoxyphenyl]-2-[acetyl(trifluoroacetyl)amino]ethyl ester, (.+-.)-
Alternate Name(s) 1-[4-(acetyloxy)-3-methoxyphenyl]-2-[acetyl(trifluoroacetyl)amino]ethyl trifluoroacetate 2-(3-Methoxy-4-acetoxyphenyl)-2-(trifluoroacetyl)-N-acetyl-N-trifluoroacetyl-ethylamine
CAS Registry Number 93667-13-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15F6NO7
InChI InChI=1S/C17H15F6NO7/c1-8(25)24(14(27)16(18,19)20)7-13(31-15(28)17(21,22)23)10-4-5-11(30-9(2)26)12(6-10)29-3/h4-6,13H,7H2,1-3H3
InChIKey KKWIMJGJKIFOLR-UHFFFAOYSA-N
Molecular Weight 459.297 g/mol
SMILES C(N(CC(OC(C(F)(F)F)=O)c1cc(OC)c(cc1)OC(=O)C)C(=O)C)(C(F)(F)F)=O
SPLASH splash10-03dj-1190000000-e8f655041d9b271f65d9
Source of Spectrum KO-11-444-7
Wiley ID 1390153