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2,2-DIMETHYL-5,6,6-TRICHLORO-5-HEXEN-3-YNOIC ACID, ETHYL ESTER
SpectraBase Compound ID 1AmxFf1YkjZ
InChI InChI=1S/C10H11Cl3O2/c1-4-15-9(14)10(2,3)6-5-7(11)8(12)13/h4H2,1-3H3
InChIKey LTPYUAJFZFTSCX-UHFFFAOYSA-N
Mol Weight 269.56 g/mol
Molecular Formula C10H11Cl3O2
Exact Mass 267.982463 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7E0wAohIuw3
Name 5,6,6-Trichloro-2,2-dimethyl-oct-5-en-3-ynoic acid, ethyl ester
CAS Registry Number 77958-39-5
Comments reassigned
Copyright Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved.
Formula C10H11Cl3O2
InChI InChI=1S/C10H11Cl3O2/c1-4-15-9(14)10(2,3)6-5-7(11)8(12)13/h4H2,1-3H3
InChIKey LTPYUAJFZFTSCX-UHFFFAOYSA-N
Literature Reference A.S. Kende, P. Fludzinski, J.H.Hill, J. Am. Chem. Soc. 103, 2904 (1981).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3