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[(S)-3-CAPROYL-2-HYDROXYPROPYL-SUCCINAMIDO]-L-LEUCINE-METHYLESTER
SpectraBase Compound ID Kn5bDx4WCTu
InChI InChI=1S/C22H40N2O7/c1-5-6-7-8-9-10-21(28)31-15-17(25)14-23-19(26)11-12-20(27)24-18(13-16(2)3)22(29)30-4/h16-18,25H,5-15H2,1-4H3,(H,23,26)(H,24,27)/t17-,18-/m0/s1
InChIKey MUCGGOREZZAYNX-ROUUACIJSA-N
Mol Weight 444.6 g/mol
Molecular Formula C22H40N2O7
Exact Mass 444.283552 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 6JM7xIguTL
Name [(S)-3-CAPROYL-2-HYDROXYPROPYL-SUCCINAMIDO]-L-LEUCINE-METHYLESTER
Compound Number 20
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C22H40N2O7
InChI InChI=1S/C22H40N2O7/c1-5-6-7-8-9-10-21(28)31-15-17(25)14-23-19(26)11-12-20(27)24-18(13-16(2)3)22(29)30-4/h16-18,25H,5-15H2,1-4H3,(H,23,26)(H,24,27)/t17-,18-/m0/s1
InChIKey MUCGGOREZZAYNX-ROUUACIJSA-N
Literature Reference Author C.GERVAISE,V.BONNET,F.NOLAY,C.CEZARD,I.STASIK,C.SARAZIN,F.DJ EDAINI-PLIARD
Literature Reference Citation EUR.J.ORG.CHEM.,2014,6200(2014)
Literature Reference DOI 10.1002/ejoc.201402414
Molecular Weight 444.569 g/mol
Solvent CDCl3
Source File Reference UWLU85402