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2-Chloro-4,4,6-trimethyl-heptanoic acid, methyl ester
SpectraBase Compound ID 18RjWTpoCVd
InChI InChI=1S/C11H21ClO2/c1-8(2)6-11(3,4)7-9(12)10(13)14-5/h8-9H,6-7H2,1-5H3
InChIKey XAIYZSITKFNSCS-UHFFFAOYSA-N
Mol Weight 220.74 g/mol
Molecular Formula C11H21ClO2
Exact Mass 220.123008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID D2qbSlRThwK
Name 2-Chloro-4,4,6-trimethyl-heptanoic acid, methyl ester
CAS Registry Number 66566-59-4
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C11H21ClO2
InChI InChI=1S/C11H21ClO2/c1-8(2)6-11(3,4)7-9(12)10(13)14-5/h8-9H,6-7H2,1-5H3
InChIKey XAIYZSITKFNSCS-UHFFFAOYSA-N
Instrument Name Bruker HX-90
Literature Reference V.I. Dostovalova, A.B. Terentev, Org. Magn. Resonance 21, 11 (1983).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CCl4