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L-Methionine, N-heptafluorobutyryl-, hexyl ester

View entire compound with spectra: 1 NMR

L-Methionine, N-heptafluorobutyryl-, hexyl ester
SpectraBase Compound ID 6GADd5KK5rS
InChI InChI=1S/C15H22F7NO3S/c1-3-4-5-6-8-26-11(24)10(7-9-27-2)23-12(25)13(16,17)14(18,19)15(20,21)22/h10H,3-9H2,1-2H3,(H,23,25)
InChIKey SYZFLABRJFVDFZ-UHFFFAOYSA-N
Mol Weight 429.39 g/mol
Molecular Formula C15H22F7NO3S
Exact Mass 429.120862 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IIZhXZ3koTc
Name L-Methionine, N-heptafluorobutyryl-, hexyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 429.120861884 u
Formula C15H22F7NO3S
InChI InChI=1S/C15H22F7NO3S/c1-3-4-5-6-8-26-11(24)10(7-9-27-2)23-12(25)13(16,17)14(18,19)15(20,21)22/h10H,3-9H2,1-2H3,(H,23,25)
InChIKey SYZFLABRJFVDFZ-UHFFFAOYSA-N
Molecular Weight 429.394 g/mol
SMILES CCCCCCOC(C(NC(C(C(C(F)(F)F)(F)F)(F)F)=O)CCSC)=O