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3,7,11-Trimethyl-dodecanoic acid, methyl ester
SpectraBase Compound ID 3cFA1tbc47C
InChI InChI=1S/C16H32O2/c1-13(2)8-6-9-14(3)10-7-11-15(4)12-16(17)18-5/h13-15H,6-12H2,1-5H3
InChIKey YMFMGLHUWRLVMT-UHFFFAOYSA-N
Mol Weight 256.4 g/mol
Molecular Formula C16H32O2
Exact Mass 256.24023 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FPYVr2yTW5o
Name 3,7,11-Trimethyl-dodecanoic acid, methyl ester
CAS Registry Number 1001-08-7
Comments AT 67.9 MHZ, ISOMER 1
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C16H32O2
InChI InChI=1S/C16H32O2/c1-13(2)8-6-9-14(3)10-7-11-15(4)12-16(17)18-5/h13-15H,6-12H2,1-5H3
InChIKey YMFMGLHUWRLVMT-UHFFFAOYSA-N
Literature Reference B.M. Trost, T.P. Klun, J. Am. Chem. Soc. 101, 6756 (1979).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent not reported