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L-isoleucine

View entire compound with spectra: 5 NMR, 7 FTIR, and 3 Raman

L-isoleucine
SpectraBase Compound ID 4UIW0aqbhjc
InChI InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1
InChIKey AGPKZVBTJJNPAG-WHFBIAKZSA-N
Mol Weight 131.17 g/mol
Molecular Formula C6H13NO2
Exact Mass 131.094629 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 4f9hZb4bv2J
Name AGPKZVBTJJNPAG-WHFBIAKZSA-N
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H13NO2
InChI InChI=1S/C6H13NO2/c1-3-4(2)5(7)6(8)9/h4-5H,3,7H2,1-2H3,(H,8,9)/t4-,5-/m0/s1
InChIKey AGPKZVBTJJNPAG-WHFBIAKZSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 131.175 g/mol
Source File Reference MHKO1580