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12-methyl-N-(pyridin-3-ylmethyl)-9,10-dihydro-9,10-ethanoanthracene-12-carboxamide

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12-methyl-N-(pyridin-3-ylmethyl)-9,10-dihydro-9,10-ethanoanthracene-12-carboxamide
SpectraBase Compound ID E8vpxREE6J0
InChI InChI=1S/C24H22N2O/c1-24(23(27)26-15-16-7-6-12-25-14-16)13-21-17-8-2-4-10-19(17)22(24)20-11-5-3-9-18(20)21/h2-12,14,21-22H,13,15H2,1H3,(H,26,27)/t21-,22?,24-/m1/s1
InChIKey IPYXTYUIUYVDKB-VUSXNOBASA-N
Mol Weight 354.45 g/mol
Molecular Formula C24H22N2O
Exact Mass 354.173213 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EKChTtHxX8R
Name 12-Methyl-N-(pyridin-3-ylmethyl)-9,10-dihydro-9,10-ethanoanthracene-12-carboxamide
Comments Computed using HOSE algorithm
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Exact Mass 354.173213335 u
Formula C24H22N2O
InChI InChI=1S/C24H22N2O/c1-24(23(27)26-15-16-7-6-12-25-14-16)13-21-17-8-2-4-10-19(17)22(24)20-11-5-3-9-18(20)21/h2-12,14,21-22H,13,15H2,1H3,(H,26,27)/t21-,22?,24-/m1/s1
InChIKey IPYXTYUIUYVDKB-VUSXNOBASA-N
Molecular Weight 354.453 g/mol
SMILES N(C([C@]1([C@]2(C3=CC=CC=C3[C@@](C1)(C=1C=CC=CC21)[H])[H])C)=O)CC1=CN=CC=C1