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L-Leucine, N-methyl-N-pentadecafluorocarbonyl-, heptadecyl ester

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L-Leucine, N-methyl-N-pentadecafluorocarbonyl-, heptadecyl ester
SpectraBase Compound ID 17cf4sG87BU
InChI InChI=1S/C32H48F15NO3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-51-24(49)23(21-22(2)3)48(4)25(50)26(33,34)27(35,36)28(37,38)29(39,40)30(41,42)31(43,44)32(45,46)47/h22-23H,5-21H2,1-4H3
InChIKey WZLQXNNWKYYZGR-UHFFFAOYSA-N
Mol Weight 779.7 g/mol
Molecular Formula C32H48F15NO3
Exact Mass 779.339467 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID jwSFbLB1DC
Name L-Leucine, N-methyl-N-pentadecafluorocarbonyl-, heptadecyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 779.339466852 u
Formula C32H48F15NO3
InChI InChI=1S/C32H48F15NO3/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-51-24(49)23(21-22(2)3)48(4)25(50)26(33,34)27(35,36)28(37,38)29(39,40)30(41,42)31(43,44)32(45,46)47/h22-23H,5-21H2,1-4H3
InChIKey WZLQXNNWKYYZGR-UHFFFAOYSA-N
Molecular Weight 779.716 g/mol
SMILES CCCCCCCCCCCCCCCCCOC(C(N(C(C(C(C(C(C(C(C(F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)(F)F)=O)C)CC(C)C)=O