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Diethyl .alpha.-acetamodo-.alpha.-(4-trifluoromethylbenzyl)malonate
SpectraBase Compound ID 3I7rcNp3nVJ
InChI InChI=1S/C17H20F3NO5/c1-4-25-14(23)16(21-11(3)22,15(24)26-5-2)10-12-6-8-13(9-7-12)17(18,19)20/h6-9H,4-5,10H2,1-3H3,(H,21,22)
InChIKey LXAJIJSLEAJJLQ-UHFFFAOYSA-N
Mol Weight 375.34 g/mol
Molecular Formula C17H20F3NO5
Exact Mass 375.129357 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ATbGsJXc5SJ
Name Diethyl .alpha.-acetamodo-.alpha.-(4-trifluoromethylbenzyl)malonate
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Formula C17H20F3NO5
InChI InChI=1S/C17H20F3NO5/c1-4-25-14(23)16(21-11(3)22,15(24)26-5-2)10-12-6-8-13(9-7-12)17(18,19)20/h6-9H,4-5,10H2,1-3H3,(H,21,22)
InChIKey LXAJIJSLEAJJLQ-UHFFFAOYSA-N
Molecular Weight 375.344 g/mol
SMILES N(C(Cc1ccc(cc1)C(F)(F)F)(C(OCC)=O)C(OCC)=O)C(=O)C
SPLASH splash10-07r9-0954000000-bc1203688b11b5639a5b
Source of Spectrum Y1-39B-14-9
Synonyms 2-Acetamido-2-[[4-(trifluoromethyl)phenyl]methyl]propanedioic acid diethyl ester Diethyl .alpha.-acetamido, .alpha.-(4-trifluoromethylbenzy)lmalonate Diethyl 2-acetamido-2-[[4-(trifluoromethyl)phenyl]methyl]propanedioate Diethyl 2-acetamido-2-(4-(trifluoromethyl)benzyl)malonate
Wiley ID 1743960