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9-(2-Dibenzylaminoethyl)-6-ethoxycarbonyl-1,2,3,4-tetrahydrocarbazole-1-one
SpectraBase Compound ID BVmg5Q5LjTo
InChI InChI=1S/C31H32N2O3/c1-2-36-31(35)25-16-17-28-27(20-25)26-14-9-15-29(34)30(26)33(28)19-18-32(21-23-10-5-3-6-11-23)22-24-12-7-4-8-13-24/h3-8,10-13,16-17,20H,2,9,14-15,18-19,21-22H2,1H3
InChIKey WGMMAXIAKYZECW-UHFFFAOYSA-N
Mol Weight 480.6 g/mol
Molecular Formula C31H32N2O3
Exact Mass 480.241293 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID DjcRHz9ddTH
Name 9-(2-Dibenzylaminoethyl)-6-ethoxycarbonyl-1,2,3,4-tetrahydrocarbazole-1-one
Comments Computed using HOSE algorithm
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Exact Mass 480.241292895 u
Formula C31H32N2O3
InChI InChI=1S/C31H32N2O3/c1-2-36-31(35)25-16-17-28-27(20-25)26-14-9-15-29(34)30(26)33(28)19-18-32(21-23-10-5-3-6-11-23)22-24-12-7-4-8-13-24/h3-8,10-13,16-17,20H,2,9,14-15,18-19,21-22H2,1H3
InChIKey WGMMAXIAKYZECW-UHFFFAOYSA-N
Molecular Weight 480.608 g/mol
SMILES C1=2N(c3c(C2CCCC1=O)cc(cc3)C(=O)OCC)CCN(Cc1ccccc1)Cc1ccccc1