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L-Methionine, N-heptafluorobutyryl-, decyl ester

View entire compound with spectra: 1 NMR

L-Methionine, N-heptafluorobutyryl-, decyl ester
SpectraBase Compound ID 6o7IVTCeStJ
InChI InChI=1S/C19H30F7NO3S/c1-3-4-5-6-7-8-9-10-12-30-15(28)14(11-13-31-2)27-16(29)17(20,21)18(22,23)19(24,25)26/h14H,3-13H2,1-2H3,(H,27,29)
InChIKey HKVIGMQBIBQLFG-UHFFFAOYSA-N
Mol Weight 485.5 g/mol
Molecular Formula C19H30F7NO3S
Exact Mass 485.183462 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 2Eq3lKHZswn
Name L-Methionine, N-heptafluorobutyryl-, decyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 485.183462142 u
Formula C19H30F7NO3S
InChI InChI=1S/C19H30F7NO3S/c1-3-4-5-6-7-8-9-10-12-30-15(28)14(11-13-31-2)27-16(29)17(20,21)18(22,23)19(24,25)26/h14H,3-13H2,1-2H3,(H,27,29)
InChIKey HKVIGMQBIBQLFG-UHFFFAOYSA-N
Molecular Weight 485.502 g/mol
SMILES CCCCCCCCCCOC(C(NC(C(C(C(F)(F)F)(F)F)(F)F)=O)CCSC)=O