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acetic acid [(1R,2S)-1-[[(1S)-1-(acetoxymethyl)-3-methyl-butyl]-methyl-carbamoyl]-2-methyl-butyl] ester
SpectraBase Compound ID CzsMujZ245F
InChI InChI=1S/C17H31NO5/c1-8-12(4)16(23-14(6)20)17(21)18(7)15(9-11(2)3)10-22-13(5)19/h11-12,15-16H,8-10H2,1-7H3/t12-,15-,16+/m0/s1
InChIKey VEHTUWNTUMRJAB-VBNZEHGJSA-N
Mol Weight 329.44 g/mol
Molecular Formula C17H31NO5
Exact Mass 329.220223 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3BLd2Lb5cOe
Name acetic acid [(1R,2S)-1-[[(1S)-1-(acetoxymethyl)-3-methyl-butyl]-methyl-carbamoyl]-2-methyl-butyl] ester
Compound Number 12
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C17H31NO5
InChI InChI=1S/C17H31NO5/c1-8-12(4)16(23-14(6)20)17(21)18(7)15(9-11(2)3)10-22-13(5)19/h11-12,15-16H,8-10H2,1-7H3/t12-,15-,16+/m0/s1
InChIKey VEHTUWNTUMRJAB-VBNZEHGJSA-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 329.437 g/mol
Sample ID 65808
Solvent CDCl3