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N-(2,4-Dimethylphenyl)-1-hexylpyrrolidine-2-carboxamide
SpectraBase Compound ID DNT7gEgiGmC
InChI InChI=1S/C19H30N2O/c1-4-5-6-7-12-21-13-8-9-18(21)19(22)20-17-11-10-15(2)14-16(17)3/h10-11,14,18H,4-9,12-13H2,1-3H3,(H,20,22)
InChIKey IWWOOSIYWXBZHO-UHFFFAOYSA-N
Mol Weight 302.46 g/mol
Molecular Formula C19H30N2O
Exact Mass 302.235814 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID jZeWis8DRg
Name N-(2,4-Dimethylphenyl)-1-hexylpyrrolidine-2-carboxamide
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 302.235813593 u
Formula C19H30N2O
InChI InChI=1S/C19H30N2O/c1-4-5-6-7-12-21-13-8-9-18(21)19(22)20-17-11-10-15(2)14-16(17)3/h10-11,14,18H,4-9,12-13H2,1-3H3,(H,20,22)
InChIKey IWWOOSIYWXBZHO-UHFFFAOYSA-N
SMILES C1C(N(CCCCCC)CC1)C(NC1=C(C)C=C(C=C1)C)=O