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Diethyl .alpha.-acetamodo-.alpha.-(3-trifluoromethylbenzyl)malonate
SpectraBase Compound ID FIVuZM2vCXV
InChI InChI=1S/C17H20F3NO5/c1-4-25-14(23)16(21-11(3)22,15(24)26-5-2)10-12-7-6-8-13(9-12)17(18,19)20/h6-9H,4-5,10H2,1-3H3,(H,21,22)
InChIKey PNXJMLDAWANCMP-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 HNKVbjQuwJM
Name Diethyl .alpha.-acetamodo-.alpha.-(3-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)10-12-7-6-8-13(9-12)17(18,19)20/h6-9H,4-5,10H2,1-3H3,(H,21,22)
InChIKey PNXJMLDAWANCMP-UHFFFAOYSA-N
Molecular Weight 375.344 g/mol
SMILES N(C(C(=O)OCC)(C(=O)OCC)Cc1cc(C(F)(F)F)ccc1)C(=O)C
SPLASH splash10-074i-0952000000-44d0c5fe2ba30e1ec76c
Source of Spectrum Y1-39-13-8
Synonyms 2-Acetamido-2-[[3-(trifluoromethyl)phenyl]methyl]propanedioic acid diethyl ester Diethyl .alpha.-acetamido, .alpha.-(3-trifluoromethylbenzy)lmalonate Diethyl 2-acetamido-2-[[3-(trifluoromethyl)phenyl]methyl]propanedioate Diethyl 2-acetamido-2-(3-(trifluoromethyl)benzyl)malonate
Wiley ID 1527987