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acetic acid [(Z)-4-keto-2-methyl-pent-1-enyl] ester
SpectraBase Compound ID 9fDjBHoVsg3
InChI InChI=1S/C8H12O3/c1-6(4-7(2)9)5-11-8(3)10/h5H,4H2,1-3H3/b6-5-
InChIKey NSFALHRHEKUWSU-WAYWQWQTSA-N
Mol Weight 156.18 g/mol
Molecular Formula C8H12O3
Exact Mass 156.078644 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 5pCi9SLjjLF
Name acetic acid [(Z)-4-keto-2-methyl-pent-1-enyl] ester
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C8H12O3
InChI InChI=1S/C8H12O3/c1-6(4-7(2)9)5-11-8(3)10/h5H,4H2,1-3H3/b6-5-
InChIKey NSFALHRHEKUWSU-WAYWQWQTSA-N
Literature Reference Author ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ
Literature Reference Citation UNI_MAINZ,INTERNAL_DB(2006)
Molecular Weight 156.181 g/mol
Source File Reference MHKO6341