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2-Butenedioic acid, 2-methyl-3-[(phenylmethyl)amino]-, diethyl ester
SpectraBase Compound ID BLDTtUR7oc7
InChI InChI=1S/C16H21NO4/c1-4-20-15(18)12(3)14(16(19)21-5-2)17-11-13-9-7-6-8-10-13/h6-10,17H,4-5,11H2,1-3H3/b14-12-
InChIKey YXZDOGRRQPMDRI-OWBHPGMISA-N
Mol Weight 291.35 g/mol
Molecular Formula C16H21NO4
Exact Mass 291.147058 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7A1gyoomEmm
Name 2-Butenedioic acid, 2-methyl-3-[(phenylmethyl)amino]-, diethyl ester
Alternate Name(s) Diethyl (2Z)-2-(benzylamino)-3-methyl-2-butenedioate Ethyl 2-benzylamino-3-carboethoxybut-2-anoate Ethyl 2-benzylamino-3-carboethoxybut-2-enoate
CAS Registry Number 107987-04-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H21NO4
InChI InChI=1S/C16H21NO4/c1-4-20-15(18)12(3)14(16(19)21-5-2)17-11-13-9-7-6-8-10-13/h6-10,17H,4-5,11H2,1-3H3/b14-12-
InChIKey YXZDOGRRQPMDRI-OWBHPGMISA-N
Molecular Weight 291.347 g/mol
SMILES N(\C(=C/(C(=O)OCC)C)C(=O)OCC)Cc1ccccc1
SPLASH splash10-0006-0090000000-34273f09030edf289bbc
Source of Spectrum F-45-84-15
Wiley ID 1294563