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(5S)-1-Benzyl-5-benzyloxymethyl-3-(3-methylbut-2-en-1-yl)pyrrolidinone

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

(5S)-1-Benzyl-5-benzyloxymethyl-3-(3-methylbut-2-en-1-yl)pyrrolidinone
SpectraBase Compound ID 7yBA2996YsW
InChI InChI=1S/C24H29NO2/c1-19(2)13-14-22-15-23(18-27-17-21-11-7-4-8-12-21)25(24(22)26)16-20-9-5-3-6-10-20/h3-13,22-23H,14-18H2,1-2H3/t22?,23-/m0/s1
InChIKey WGLUIPCPGNXSDS-WCSIJFPASA-N
Mol Weight 363.5 g/mol
Molecular Formula C24H29NO2
Exact Mass 363.219829 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FcaIK2whHuq
Name (5S)-1-Benzyl-5-benzyloxymethyl-3-(3-methylbut-2-en-1-yl)pyrrolidinone
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 363.219829176 u
Formula C24H29NO2
InChI InChI=1S/C24H29NO2/c1-19(2)13-14-22-15-23(18-27-17-21-11-7-4-8-12-21)25(24(22)26)16-20-9-5-3-6-10-20/h3-13,22-23H,14-18H2,1-2H3/t22?,23-/m0/s1
InChIKey WGLUIPCPGNXSDS-WCSIJFPASA-N
Molecular Weight 363.501 g/mol
SMILES C1(N([C@@](CC1CC=C(C)C)(COCC1=CC=CC=C1)[H])CC1=CC=CC=C1)=O