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2-[2-(4-Phenyl-piperidin-1-yl)-ethyl]-isoindole-1,3-dione

View entire compound with spectra: 1 NMR

2-[2-(4-Phenyl-piperidin-1-yl)-ethyl]-isoindole-1,3-dione
SpectraBase Compound ID 2MC4EzjzXIi
InChI InChI=1S/C21H22N2O2/c24-20-18-8-4-5-9-19(18)21(25)23(20)15-14-22-12-10-17(11-13-22)16-6-2-1-3-7-16/h1-9,17H,10-15H2
InChIKey LLUHGZIDORKRTF-UHFFFAOYSA-N
Mol Weight 334.42 g/mol
Molecular Formula C21H22N2O2
Exact Mass 334.168128 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1ay3B0MjIZX
Name 2-[2-(4-Phenyl-piperidin-1-yl)-ethyl]-isoindole-1,3-dione
Comments Computed using HOSE algorithm
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Exact Mass 334.168127954 u
Formula C21H22N2O2
InChI InChI=1S/C21H22N2O2/c24-20-18-8-4-5-9-19(18)21(25)23(20)15-14-22-12-10-17(11-13-22)16-6-2-1-3-7-16/h1-9,17H,10-15H2
InChIKey LLUHGZIDORKRTF-UHFFFAOYSA-N
Molecular Weight 334.419 g/mol
SMILES C1(N(C(C2=CC=CC=C12)=O)CCN1CCC(CC1)C1=CC=CC=C1)=O