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L-Norvalyl-L-norvaline, N-benzyloxycarbonyl-, butyl ester

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L-Norvalyl-L-norvaline, N-benzyloxycarbonyl-, butyl ester
SpectraBase Compound ID 9jSdeG51kdy
InChI InChI=1S/C22H34N2O5/c1-4-7-15-28-21(26)19(12-6-3)23-20(25)18(11-5-2)24-22(27)29-16-17-13-9-8-10-14-17/h8-10,13-14,18-19H,4-7,11-12,15-16H2,1-3H3,(H,23,25)(H,24,27)
InChIKey ZACBHXYJDONNHH-UHFFFAOYSA-N
Mol Weight 406.5 g/mol
Molecular Formula C22H34N2O5
Exact Mass 406.246772 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GmQIkmqGWxA
Name L-Norvalyl-L-norvaline, N-benzyloxycarbonyl-, butyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 406.246772198 u
Formula C22H34N2O5
InChI InChI=1S/C22H34N2O5/c1-4-7-15-28-21(26)19(12-6-3)23-20(25)18(11-5-2)24-22(27)29-16-17-13-9-8-10-14-17/h8-10,13-14,18-19H,4-7,11-12,15-16H2,1-3H3,(H,23,25)(H,24,27)
InChIKey ZACBHXYJDONNHH-UHFFFAOYSA-N
Molecular Weight 406.523 g/mol
SMILES C1(=CC=CC=C1)COC(NC(C(NC(C(OCCCC)=O)CCC)=O)CCC)=O