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(E)-5-(1,3-benzodioxol-5-yl)-1-(4-morpholinyl)-2-penten-1-one

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

(E)-5-(1,3-benzodioxol-5-yl)-1-(4-morpholinyl)-2-penten-1-one
SpectraBase Compound ID L2CCpMgRzSP
InChI InChI=1S/C16H19NO4/c18-16(17-7-9-19-10-8-17)4-2-1-3-13-5-6-14-15(11-13)21-12-20-14/h2,4-6,11H,1,3,7-10,12H2/b4-2+
InChIKey PKKNQHAFVNYOFB-DUXPYHPUSA-N
Mol Weight 289.33 g/mol
Molecular Formula C16H19NO4
Exact Mass 289.131408 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CTNCLqrfsJL
Name (E)-5-(1,3-Benzodioxol-5-yl)-1-(4-morpholinyl)-2-penten-1-one
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 289.131408092 u
Formula C16H19NO4
InChI InChI=1S/C16H19NO4/c18-16(17-7-9-19-10-8-17)4-2-1-3-13-5-6-14-15(11-13)21-12-20-14/h2,4-6,11H,1,3,7-10,12H2/b4-2+
InChIKey PKKNQHAFVNYOFB-DUXPYHPUSA-N
SMILES C(N1CCOCC1)(\C=C\CCC=1C=C2OCOC2=CC1)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.978519