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Ethyl (E)-2-acetyl -5-(carboethoxy)pen-4-enoate

View entire compound with spectra: 1 NMR, 1 FTIR, and 1 MS (GC)

Ethyl (E)-2-acetyl -5-(carboethoxy)pen-4-enoate
SpectraBase Compound ID B4g6ChexepS
InChI InChI=1S/C12H19NO5/c1-4-17-11(15)8-6-7-10(13-9(3)14)12(16)18-5-2/h6,8,10H,4-5,7H2,1-3H3,(H,13,14)/b8-6+
InChIKey QTDKLESKQSRANV-SOFGYWHQSA-N
Mol Weight 257.29 g/mol
Molecular Formula C12H19NO5
Exact Mass 257.126323 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7mE0El5Kmus
Name Ethyl (E)-2-acetyl -5-(carboethoxy)pen-4-enoate
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H19NO5
InChI InChI=1S/C12H19NO5/c1-4-17-11(15)8-6-7-10(13-9(3)14)12(16)18-5-2/h6,8,10H,4-5,7H2,1-3H3,(H,13,14)/b8-6+
InChIKey QTDKLESKQSRANV-SOFGYWHQSA-N
Molecular Weight 257.286 g/mol
SMILES N(C(C(=O)OCC)C\C=C\C(=O)OCC)C(=O)C
SPLASH splash10-002f-6900000000-69630e1043b25251eb11
Source of Spectrum F-50-2637-10
Wiley ID 1260666