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Dimethyl 2-amino-3-benzylbut-2-enedioate
SpectraBase Compound ID 5JHp6UbcBS8
InChI InChI=1S/C13H15NO4/c1-17-12(15)10(11(14)13(16)18-2)8-9-6-4-3-5-7-9/h3-7H,8,14H2,1-2H3/b11-10-
InChIKey PGNUQUMQHPCPEV-KHPPLWFESA-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 3LdZrFKX56u
Name Dimethyl 2-amino-3-benzylbut-2-enedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO4
InChI InChI=1S/C13H15NO4/c1-17-12(15)10(11(14)13(16)18-2)8-9-6-4-3-5-7-9/h3-7H,8,14H2,1-2H3/b11-10-
InChIKey PGNUQUMQHPCPEV-KHPPLWFESA-N
Molecular Weight 249.266 g/mol
SMILES N\C(=C/(C(=O)OC)Cc1ccccc1)C(=O)OC
SPLASH splash10-0k96-1910000000-ec6e696b0fc7a1bbbcc8
Source of Spectrum AC-133-212-18
Synonyms Dimethyl (2Z)-2-amino-3-benzyl-2-butenedioate
Wiley ID 812121