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2-propen-1-one, 3-(4-chlorophenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-, (2E)-

View entire compound with spectra: 3 NMR

2-propen-1-one, 3-(4-chlorophenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-, (2E)-
SpectraBase Compound ID CoZ8eDoboXw
InChI InChI=1S/C17H13ClO3/c18-14-5-1-12(2-6-14)3-7-15(19)13-4-8-16-17(11-13)21-10-9-20-16/h1-8,11H,9-10H2/b7-3+
InChIKey STAKSKOJGMAVRV-XVNBXDOJSA-N
Mol Weight 300.74 g/mol
Molecular Formula C17H13ClO3
Exact Mass 300.055322 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID AKjENeos3c
Name 2-Propen-1-one, 3-(4-chlorophenyl)-1-(2,3-dihydro-1,4-benzodioxin-6-yl)-, (2E)-
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 300.055321976 u
Formula C17H13ClO3
InChI InChI=1S/C17H13ClO3/c18-14-5-1-12(2-6-14)3-7-15(19)13-4-8-16-17(11-13)21-10-9-20-16/h1-8,11H,9-10H2/b7-3+
InChIKey STAKSKOJGMAVRV-XVNBXDOJSA-N
Molecular Weight 300.741 g/mol
SMILES C(\C=C\C=1C=CC(=CC1)Cl)(C=1C=C2OCCOC2=CC1)=O