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DL-Aspartic acid, N-(phenylmethylene)-, dimethyl ester
SpectraBase Compound ID AbNTGiLqWiq
InChI InChI=1S/C13H15NO4/c1-17-12(15)8-11(13(16)18-2)14-9-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/b14-9+
InChIKey SYHFTHGTZXTEKV-NTEUORMPSA-N
Mol Weight 249.27 g/mol
Molecular Formula C13H15NO4
Exact Mass 249.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D02N1ak0RTZ
Name DL-Aspartic acid, N-(phenylmethylene)-, dimethyl ester
CAS Registry Number 113370-62-0
Comments Less than 3 mono-isotopic peaks
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Formula C13H15NO4
InChI InChI=1S/C13H15NO4/c1-17-12(15)8-11(13(16)18-2)14-9-10-6-4-3-5-7-10/h3-7,9,11H,8H2,1-2H3/b14-9+
InChIKey SYHFTHGTZXTEKV-NTEUORMPSA-N
Molecular Weight 249.266 g/mol
SMILES C(C(\N=C\c1ccccc1)C(=O)OC)C(=O)OC
SPLASH splash10-0006-0900000000-426be5d933c6e4b6057f
Source of Spectrum KC-1987-2291-6
Synonyms dimethyl 2-{[(E)-phenylmethylidene]amino}succinate Dimethyl N-benzylideneaspartate
Wiley ID 1252132