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2-Ethoxycarbonyl-3-[methyl(phenyl)amino]hept-2-enoic acid
SpectraBase Compound ID Dprm8KdvgLl
InChI InChI=1S/C17H23NO4/c1-4-6-12-14(15(16(19)20)17(21)22-5-2)18(3)13-10-8-7-9-11-13/h7-11H,4-6,12H2,1-3H3,(H,19,20)/b15-14-
InChIKey VOLQSGCOKJUTTE-PFONDFGASA-N
Mol Weight 305.37 g/mol
Molecular Formula C17H23NO4
Exact Mass 305.162708 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6cJGob7KygL
Name 2-Ethoxycarbonyl-3-[methyl(phenyl)amino]hept-2-enoic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H23NO4
InChI InChI=1S/C17H23NO4/c1-4-6-12-14(15(16(19)20)17(21)22-5-2)18(3)13-10-8-7-9-11-13/h7-11H,4-6,12H2,1-3H3,(H,19,20)/b15-14-
InChIKey VOLQSGCOKJUTTE-PFONDFGASA-N
Molecular Weight 305.374 g/mol
SMILES OC(\C(=C/(N(c1ccccc1)C)CCCC)C(=O)OCC)=O
SPLASH splash10-02t9-0091000000-1ce15737e68b2006c296
Source of Spectrum B-48-55-0
Synonyms (2Z)-2-(ethoxycarbonyl)-3-(methylanilino)-2-heptenoic acid
Wiley ID 1307349