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ECTOINE

View entire compound with spectra: 1 NMR

ECTOINE
SpectraBase Compound ID Qm5Pt4wU0G
InChI InChI=1S/C6H10N2O2/c1-4-7-3-2-5(8-4)6(9)10/h5H,2-3H2,1H3,(H,7,8)(H,9,10)
InChIKey WQXNXVUDBPYKBA-UHFFFAOYSA-N
Mol Weight 142.16 g/mol
Molecular Formula C6H10N2O2
Exact Mass 142.074228 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID I5KnkCRcpGe
Name ECTOINE
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C6H10N2O2
InChI InChI=1S/C6H10N2O2/c1-4-7-3-2-5(8-4)6(9)10/h5H,2-3H2,1H3,(H,7,8)(H,9,10)
InChIKey WQXNXVUDBPYKBA-UHFFFAOYSA-N
Literature Reference Author L.CASTELLANOS,C.DUQUE,S.ZEA,A.ESPADA,J.RODRIGUEZ,C.JIMENEZ
Literature Reference Citation ORG.LETTERS,8,4967(2006)
Literature Reference DOI 10.1021/ol062087k
Molecular Weight 142.158 g/mol
Sample ID 60835
Solvent CDCl3