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L-nva- L-nle, N-(Benzyloxycarbonyl)-, N-butyl ester

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L-nva- L-nle, N-(Benzyloxycarbonyl)-, N-butyl ester
SpectraBase Compound ID HZaZfZNhFMx
InChI InChI=1S/C23H36N2O5/c1-4-7-15-20(22(27)29-16-8-5-2)24-21(26)19(12-6-3)25-23(28)30-17-18-13-10-9-11-14-18/h9-11,13-14,19-20H,4-8,12,15-17H2,1-3H3,(H,24,26)(H,25,28)
InChIKey JINCSRDDWOAFRD-UHFFFAOYSA-N
Mol Weight 420.6 g/mol
Molecular Formula C23H36N2O5
Exact Mass 420.262422 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7hRddokPtru
Name L-nva- L-nle, N-(Benzyloxycarbonyl)-, N-butyl ester
Comments Computed using HOSE algorithm
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 420.262422262 u
Formula C23H36N2O5
InChI InChI=1S/C23H36N2O5/c1-4-7-15-20(22(27)29-16-8-5-2)24-21(26)19(12-6-3)25-23(28)30-17-18-13-10-9-11-14-18/h9-11,13-14,19-20H,4-8,12,15-17H2,1-3H3,(H,24,26)(H,25,28)
InChIKey JINCSRDDWOAFRD-UHFFFAOYSA-N
Molecular Weight 420.550 g/mol
SMILES C1(=CC=CC=C1)COC(NC(C(NC(CCCC)C(=O)OCCCC)=O)CCC)=O