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L-Leucine, N-cyclopropylcarbonyl-, undecyl ester
SpectraBase Compound ID 2pHQXD0Jts
InChI InChI=1S/C21H39NO3/c1-4-5-6-7-8-9-10-11-12-15-25-21(24)19(16-17(2)3)22-20(23)18-13-14-18/h17-19H,4-16H2,1-3H3,(H,22,23)
InChIKey PJZKPBZNLLFXBG-UHFFFAOYSA-N
Mol Weight 353.5 g/mol
Molecular Formula C21H39NO3
Exact Mass 353.292994 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CbqLdhsXOH7
Name L-Leucine, N-cyclopropylcarbonyl-, undecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 353.292994117 u
Formula C21H39NO3
InChI InChI=1S/C21H39NO3/c1-4-5-6-7-8-9-10-11-12-15-25-21(24)19(16-17(2)3)22-20(23)18-13-14-18/h17-19H,4-16H2,1-3H3,(H,22,23)
InChIKey PJZKPBZNLLFXBG-UHFFFAOYSA-N
Molecular Weight 353.547 g/mol
SMILES C(NC(C(OCCCCCCCCCCC)=O)CC(C)C)(=O)C1CC1