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1-Benzyl-4-(benzyloxy)-5-propyl-2-pyrrolidinone
SpectraBase Compound ID BW4K6thdlE8
InChI InChI=1S/C21H25NO2/c1-2-9-19-20(24-16-18-12-7-4-8-13-18)14-21(23)22(19)15-17-10-5-3-6-11-17/h3-8,10-13,19-20H,2,9,14-16H2,1H3
InChIKey OYHBCLXGXNPGFJ-UHFFFAOYSA-N
Mol Weight 323.44 g/mol
Molecular Formula C21H25NO2
Exact Mass 323.188529 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EZHDLRdWiOc
Name 1-Benzyl-4-(benzyloxy)-5-propyl-2-pyrrolidinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 323.188529047 u
Formula C21H25NO2
InChI InChI=1S/C21H25NO2/c1-2-9-19-20(24-16-18-12-7-4-8-13-18)14-21(23)22(19)15-17-10-5-3-6-11-17/h3-8,10-13,19-20H,2,9,14-16H2,1H3
InChIKey OYHBCLXGXNPGFJ-UHFFFAOYSA-N
Molecular Weight 323.436 g/mol
SMILES C1(N(C(C(C1)OCC=1C=CC=CC1)CCC)CC=1C=CC=CC1)=O