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8-Hydroxy-12-methyl-3-oxo-tridec-6-en-oic acid, methyl ester
SpectraBase Compound ID AhM19tcHTGB
InChI InChI=1S/C15H26O4/c1-12(2)7-6-10-13(16)8-4-5-9-14(17)11-15(18)19-3/h4,8,12-13,16H,5-7,9-11H2,1-3H3/b8-4+
InChIKey BAEJTVBBENRQQA-XBXARRHUSA-N
Mol Weight 270.37 g/mol
Molecular Formula C15H26O4
Exact Mass 270.183109 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID CDQBz2DAjmQ
Name 8-Hydroxy-12-methyl-3-oxo-tridec-6-en-oic acid, methyl ester
CAS Registry Number 76042-79-0
Comments MIXTURE OF E AND Z ISOMER HIGH FIELD RESONANCES|REASSIGNED A.H.
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C15H26O4
InChI InChI=1S/C15H26O4/c1-12(2)7-6-10-13(16)8-4-5-9-14(17)11-15(18)19-3/h4,8,12-13,16H,5-7,9-11H2,1-3H3/b8-4+
InChIKey BAEJTVBBENRQQA-XBXARRHUSA-N
Instrument Name Jeol FX-60
Literature Reference B.M. Trost, L.N. Jungheim, J. Am. Chem. Soc. 102, 7910 (1980).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3