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1-(3-methylphenyl)-4-(1-pentyl-1H-benzimidazol-2-yl)-2-pyrrolidinone

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1-(3-methylphenyl)-4-(1-pentyl-1H-benzimidazol-2-yl)-2-pyrrolidinone
SpectraBase Compound ID 4ZZm8MXMcDs
InChI InChI=1S/C23H27N3O/c1-3-4-7-13-25-21-12-6-5-11-20(21)24-23(25)18-15-22(27)26(16-18)19-10-8-9-17(2)14-19/h5-6,8-12,14,18H,3-4,7,13,15-16H2,1-2H3
InChIKey XFZVSPNPUPEPHP-UHFFFAOYSA-N
Mol Weight 361.49 g/mol
Molecular Formula C23H27N3O
Exact Mass 361.215413 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 8F5FrqYL4DF
Name 1-(3-Methylphenyl)-4-(1-pentyl-1H-benzimidazol-2-yl)-2-pyrrolidinone
Comments Computed using HOSE algorithm
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Exact Mass 361.215412500 u
Formula C23H27N3O
InChI InChI=1S/C23H27N3O/c1-3-4-7-13-25-21-12-6-5-11-20(21)24-23(25)18-15-22(27)26(16-18)19-10-8-9-17(2)14-19/h5-6,8-12,14,18H,3-4,7,13,15-16H2,1-2H3
InChIKey XFZVSPNPUPEPHP-UHFFFAOYSA-N
Molecular Weight 361.489 g/mol
SMILES C1(=NC2=CC=CC=C2N1CCCCC)C1CN(C=2C=C(C)C=CC2)C(C1)=O