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

*Links on SpectraBase are not permalinks.

L-Leucyl-L-alanine, N-methoxycarbonyl-, 2,2,3,3,4,4,4-heptafluorobutyl ester

View entire compound with spectra: 1 NMR

L-Leucyl-L-alanine, N-methoxycarbonyl-, 2,2,3,3,4,4,4-heptafluorobutyl ester
SpectraBase Compound ID nR2RG5tL5D
InChI InChI=1S/C15H21F7N2O5/c1-7(2)5-9(24-12(27)28-4)10(25)23-8(3)11(26)29-6-13(16,17)14(18,19)15(20,21)22/h7-9H,5-6H2,1-4H3,(H,23,25)(H,24,27)
InChIKey LXCVASCGJJUFJL-UHFFFAOYSA-N
Mol Weight 442.33 g/mol
Molecular Formula C15H21F7N2O5
Exact Mass 442.133869 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 9kALrOsn4Xy
Name L-Leucyl-L-alanine, N-methoxycarbonyl-, 2,2,3,3,4,4,4-heptafluorobutyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 442.133868920 u
Formula C15H21F7N2O5
InChI InChI=1S/C15H21F7N2O5/c1-7(2)5-9(24-12(27)28-4)10(25)23-8(3)11(26)29-6-13(16,17)14(18,19)15(20,21)22/h7-9H,5-6H2,1-4H3,(H,23,25)(H,24,27)
InChIKey LXCVASCGJJUFJL-UHFFFAOYSA-N
Molecular Weight 442.331 g/mol
SMILES C(C(NC(OC)=O)CC(C)C)(=O)NC(C(OCC(C(C(F)(F)F)(F)F)(F)F)=O)C