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7-Nitro-N-(phenylmethyl)-1,2,3,4-tetrahydroacridin-9-amine
SpectraBase Compound ID 7dchTC50Xy1
InChI InChI=1S/C20H19N3O2/c24-23(25)15-10-11-19-17(12-15)20(16-8-4-5-9-18(16)22-19)21-13-14-6-2-1-3-7-14/h1-3,6-7,10-12H,4-5,8-9,13H2,(H,21,22)
InChIKey SIWYMMBMGFYGRC-UHFFFAOYSA-N
Mol Weight 333.39 g/mol
Molecular Formula C20H19N3O2
Exact Mass 333.147727 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID HCqi0sSNrZ3
Name 7-Nitro-N-(phenylmethyl)-1,2,3,4-tetrahydroacridin-9-amine
Comments Computed using HOSE algorithm
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Exact Mass 333.147726862 u
Formula C20H19N3O2
InChI InChI=1S/C20H19N3O2/c24-23(25)15-10-11-19-17(12-15)20(16-8-4-5-9-18(16)22-19)21-13-14-6-2-1-3-7-14/h1-3,6-7,10-12H,4-5,8-9,13H2,(H,21,22)
InChIKey SIWYMMBMGFYGRC-UHFFFAOYSA-N
Molecular Weight 333.391 g/mol
SMILES C1CCCC2=NC3=CC=C(C=C3C(=C12)NCC=1C=CC=CC1)N(=O)=O