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(4R,5R,6R)-4,5,6-trihydroxy-2-methylcyclohex-2-en-1-one
SpectraBase Compound ID 4TvSz7kspUl
InChI InChI=1S/C7H10O4/c1-3-2-4(8)6(10)7(11)5(3)9/h2,4,6-8,10-11H,1H3/t4-,6-,7+/m1/s1
InChIKey YNPFEYUTCGDFDD-QXRNQMCJSA-N
Mol Weight 158.15 g/mol
Molecular Formula C7H10O4
Exact Mass 158.057909 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID EiEFSWpt3k3
Name (4R,5R,6R)-4,5,6-trihydroxy-2-methylcyclohex-2-en-1-one
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C7H10O4
InChI InChI=1S/C7H10O4/c1-3-2-4(8)6(10)7(11)5(3)9/h2,4,6-8,10-11H,1H3/t4-,6-,7+/m1/s1
InChIKey YNPFEYUTCGDFDD-QXRNQMCJSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 158.154 g/mol
Source File Reference MHKO1979