For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

4-(1-hexadecyl-1H-benzimidazol-2-yl)-1-(3-methoxyphenyl)-2-pyrrolidinone

View entire compound with spectra: 2 NMR

4-(1-hexadecyl-1H-benzimidazol-2-yl)-1-(3-methoxyphenyl)-2-pyrrolidinone
SpectraBase Compound ID KnVOUabJBw2
InChI InChI=1S/C34H49N3O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-24-36-32-23-17-16-22-31(32)35-34(36)28-25-33(38)37(27-28)29-20-19-21-30(26-29)39-2/h16-17,19-23,26,28H,3-15,18,24-25,27H2,1-2H3
InChIKey WNZJTZQETCLYAR-UHFFFAOYSA-N
Mol Weight 531.8 g/mol
Molecular Formula C34H49N3O2
Exact Mass 531.382478 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID DapffiSqyNT
Name 4-(1-Hexadecyl-1H-benzimidazol-2-yl)-1-(3-methoxyphenyl)-2-pyrrolidinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 531.382477828 u
Formula C34H49N3O2
InChI InChI=1S/C34H49N3O2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-18-24-36-32-23-17-16-22-31(32)35-34(36)28-25-33(38)37(27-28)29-20-19-21-30(26-29)39-2/h16-17,19-23,26,28H,3-15,18,24-25,27H2,1-2H3
InChIKey WNZJTZQETCLYAR-UHFFFAOYSA-N
Molecular Weight 531.785 g/mol
SMILES C1(=NC2=CC=CC=C2N1CCCCCCCCCCCCCCCC)C1CN(C=2C=C(OC)C=CC2)C(C1)=O