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L-Methionine, N-pentafluoropropionyl-, nonyl ester

View entire compound with spectra: 1 NMR

L-Methionine, N-pentafluoropropionyl-, nonyl ester
SpectraBase Compound ID HLTqYaGvqk8
InChI InChI=1S/C17H28F5NO3S/c1-3-4-5-6-7-8-9-11-26-14(24)13(10-12-27-2)23-15(25)16(18,19)17(20,21)22/h13H,3-12H2,1-2H3,(H,23,25)
InChIKey XBLRLROWVPYLCX-UHFFFAOYSA-N
Mol Weight 421.47 g/mol
Molecular Formula C17H28F5NO3S
Exact Mass 421.171006 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID Dd7qD876Wwd
Name L-Methionine, N-pentafluoropropionyl-, nonyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 421.171005752 u
Formula C17H28F5NO3S
InChI InChI=1S/C17H28F5NO3S/c1-3-4-5-6-7-8-9-11-26-14(24)13(10-12-27-2)23-15(25)16(18,19)17(20,21)22/h13H,3-12H2,1-2H3,(H,23,25)
InChIKey XBLRLROWVPYLCX-UHFFFAOYSA-N
Molecular Weight 421.467 g/mol
SMILES CCCCCCCCCOC(C(NC(C(C(F)(F)F)(F)F)=O)CCSC)=O