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L-Isoleucyl-L-alanine, N-isobutoxycarbonyl-, propyl ester

View entire compound with spectra: 1 NMR

L-Isoleucyl-L-alanine, N-isobutoxycarbonyl-, propyl ester
SpectraBase Compound ID 22Q0xdwYBLG
InChI InChI=1S/C17H32N2O5/c1-7-9-23-16(21)13(6)18-15(20)14(12(5)8-2)19-17(22)24-10-11(3)4/h11-14H,7-10H2,1-6H3,(H,18,20)(H,19,22)
InChIKey XWDSKOYTGPYTSI-UHFFFAOYSA-N
Mol Weight 344.5 g/mol
Molecular Formula C17H32N2O5
Exact Mass 344.231122 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 823Fj6zbIHK
Name L-Isoleucyl-L-alanine, N-isobutoxycarbonyl-, propyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 344.231122133 u
Formula C17H32N2O5
InChI InChI=1S/C17H32N2O5/c1-7-9-23-16(21)13(6)18-15(20)14(12(5)8-2)19-17(22)24-10-11(3)4/h11-14H,7-10H2,1-6H3,(H,18,20)(H,19,22)
InChIKey XWDSKOYTGPYTSI-UHFFFAOYSA-N
Molecular Weight 344.452 g/mol
SMILES CC(COC(NC(C(NC(C)C(OCCC)=O)=O)C(CC)C)=O)C