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1-Benzyl-4-(benzyloxy)-5-heptyl-2-pyrrolidinone

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-Benzyl-4-(benzyloxy)-5-heptyl-2-pyrrolidinone
SpectraBase Compound ID 7bk0zyk4Jl
InChI InChI=1S/C25H33NO2/c1-2-3-4-5-12-17-23-24(28-20-22-15-10-7-11-16-22)18-25(27)26(23)19-21-13-8-6-9-14-21/h6-11,13-16,23-24H,2-5,12,17-20H2,1H3
InChIKey PDTWEGGQYRTGLP-UHFFFAOYSA-N
Mol Weight 379.5 g/mol
Molecular Formula C25H33NO2
Exact Mass 379.251129 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GbssabiAD1u
Name 1-Benzyl-4-(benzyloxy)-5-heptyl-2-pyrrolidinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 379.251129305 u
Formula C25H33NO2
InChI InChI=1S/C25H33NO2/c1-2-3-4-5-12-17-23-24(28-20-22-15-10-7-11-16-22)18-25(27)26(23)19-21-13-8-6-9-14-21/h6-11,13-16,23-24H,2-5,12,17-20H2,1H3
InChIKey PDTWEGGQYRTGLP-UHFFFAOYSA-N
Molecular Weight 379.544 g/mol
SMILES C1(N(C(C(C1)OCC=1C=CC=CC1)CCCCCCC)CC=1C=CC=CC1)=O