For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.

L-Methionyl-L-methionine, N-heptafluorobutyryl-, ethyl ester

View entire compound with spectra: 1 NMR

L-Methionyl-L-methionine, N-heptafluorobutyryl-, ethyl ester
SpectraBase Compound ID A1W5i87tL2j
InChI InChI=1S/C16H23F7N2O4S2/c1-4-29-12(27)10(6-8-31-3)24-11(26)9(5-7-30-2)25-13(28)14(17,18)15(19,20)16(21,22)23/h9-10H,4-8H2,1-3H3,(H,24,26)(H,25,28)
InChIKey JZYUUBCFPALJSY-UHFFFAOYSA-N
Mol Weight 504.48 g/mol
Molecular Formula C16H23F7N2O4S2
Exact Mass 504.098747 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID EwRHoTZWs7t
Name L-Methionyl-L-methionine, N-heptafluorobutyryl-, ethyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 504.098746714 u
Formula C16H23F7N2O4S2
InChI InChI=1S/C16H23F7N2O4S2/c1-4-29-12(27)10(6-8-31-3)24-11(26)9(5-7-30-2)25-13(28)14(17,18)15(19,20)16(21,22)23/h9-10H,4-8H2,1-3H3,(H,24,26)(H,25,28)
InChIKey JZYUUBCFPALJSY-UHFFFAOYSA-N
Molecular Weight 504.479 g/mol
SMILES C(C(C(C(NC(C(NC(C(OCC)=O)CCSC)=O)CCSC)=O)(F)F)(F)F)(F)(F)F