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2,3-Dihydro-3-(2-phenylethylidene)-2-[(4-methoxyphenyl)methyl]-1H-isoindol-1-one
SpectraBase Compound ID G5vwpsmd15I
InChI InChI=1S/C24H21NO2/c1-27-20-14-11-19(12-15-20)17-25-23(16-13-18-7-3-2-4-8-18)21-9-5-6-10-22(21)24(25)26/h2-12,14-16H,13,17H2,1H3/b23-16+
InChIKey QLHHRIOKFNLJLA-XQNSMLJCSA-N
Mol Weight 355.44 g/mol
Molecular Formula C24H21NO2
Exact Mass 355.157229 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4eWcpLWCKd6
Name 2,3-Dihydro-3-(2-phenylethylidene)-2-[(4-methoxyphenyl)methyl]-1H-isoindol-1-one
Comments Computed using HOSE algorithm
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Exact Mass 355.157228918 u
Formula C24H21NO2
InChI InChI=1S/C24H21NO2/c1-27-20-14-11-19(12-15-20)17-25-23(16-13-18-7-3-2-4-8-18)21-9-5-6-10-22(21)24(25)26/h2-12,14-16H,13,17H2,1H3/b23-16+
InChIKey QLHHRIOKFNLJLA-XQNSMLJCSA-N
Molecular Weight 355.437 g/mol
SMILES C=12\C(N(C(C1C=CC=C2)=O)CC=1C=CC(=CC1)OC)=C/CC=1C=CC=CC1