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N-{[3,4-(Methylenedioxy)anilino]methyl}phthalimide
SpectraBase Compound ID BUBex5YOFLI
InChI InChI=1S/C16H12N2O4/c19-15-11-3-1-2-4-12(11)16(20)18(15)8-17-10-5-6-13-14(7-10)22-9-21-13/h1-7,17H,8-9H2
InChIKey MWECHFLHEMPPIJ-UHFFFAOYSA-N
Mol Weight 296.28 g/mol
Molecular Formula C16H12N2O4
Exact Mass 296.079707 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3lIfeyysXhZ
Name N-{[3,4-(Methylenedioxy)anilino]methyl}phthalimide
Comments Computed using HOSE algorithm
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Exact Mass 296.079706870 u
Formula C16H12N2O4
InChI InChI=1S/C16H12N2O4/c19-15-11-3-1-2-4-12(11)16(20)18(15)8-17-10-5-6-13-14(7-10)22-9-21-13/h1-7,17H,8-9H2
InChIKey MWECHFLHEMPPIJ-UHFFFAOYSA-N
SMILES N(C=1C=CC=2OCOC2C1)CN1C(C=2C=CC=CC2C1=O)=O