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(2R,4S)-2,4,5-TRIMETHYL-5-HEXENOIC ACID, METHYL ESTER
SpectraBase Compound ID 1rH99l6v1T9
InChI InChI=1S/C10H18O2/c1-7(2)8(3)6-9(4)10(11)12-5/h8-9H,1,6H2,2-5H3
InChIKey LAFKODLFQRHKCA-UHFFFAOYSA-N
Mol Weight 170.25 g/mol
Molecular Formula C10H18O2
Exact Mass 170.13068 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1TETWDee0s0
Name 2(S),4(S),5-Trimethyl-5-hexenoic acid, methyl ester
CAS Registry Number 80865-14-1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H18O2
InChI InChI=1S/C10H18O2/c1-7(2)8(3)6-9(4)10(11)12-5/h8-9H,1,6H2,2-5H3
InChIKey LAFKODLFQRHKCA-UHFFFAOYSA-N
Instrument Name Jeol FX-90
Literature Reference J.V. Duncia, P.T. Lansbury, T. Miller, J. Am. Chem. Soc. 104, 1930 (1982).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3