John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=5AaGXYD0GXA SpectraBase Spectrum ID=1knJsYUeagF

(accessed ).
acetic acid [(2S)-2-[[(2R)-2-acetoxy-3-methyl-butanoyl]-methyl-amino]-4-methyl-pentyl] ester
SpectraBase Compound ID 5AaGXYD0GXA
InChI InChI=1S/C16H29NO5/c1-10(2)8-14(9-21-12(5)18)17(7)16(20)15(11(3)4)22-13(6)19/h10-11,14-15H,8-9H2,1-7H3/t14-,15+/m0/s1
InChIKey DHJZWPYDDNUQTM-LSDHHAIUSA-N
Mol Weight 315.41 g/mol
Molecular Formula C16H29NO5
Exact Mass 315.204573 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1knJsYUeagF
Name acetic acid [(2S)-2-[[(2R)-2-acetoxy-3-methyl-butanoyl]-methyl-amino]-4-methyl-pentyl] ester
Compound Number 10
Copyright Copyright © 2016-2021 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C16H29NO5
InChI InChI=1S/C16H29NO5/c1-10(2)8-14(9-21-12(5)18)17(7)16(20)15(11(3)4)22-13(6)19/h10-11,14-15H,8-9H2,1-7H3/t14-,15+/m0/s1
InChIKey DHJZWPYDDNUQTM-LSDHHAIUSA-N
Literature Reference Author S.SUPOTHINA,M.ISAKA,K.KIRTIKARA,M.TANTICHAROEN,Y.THEBTARANON TH
Literature Reference Citation J.ANTIBIOTICS,57,732(2004)
Literature Reference DOI 10.7164/antibiotics.57.732
Molecular Weight 315.410 g/mol
Sample ID 65806
Solvent CDCl3
SpectraBase Batch ID 20ve6pDpH3q