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ETHYL-7-CHLORO-3,7-DIMETHYL-(2E)-OCTENOATE
SpectraBase Compound ID 9lOOKrh8mja
InChI InChI=1S/C12H21ClO2/c1-5-15-11(14)9-10(2)7-6-8-12(3,4)13/h9H,5-8H2,1-4H3/b10-9+
InChIKey ZRTFTFPNBMPZOH-MDZDMXLPSA-N
Mol Weight 232.75 g/mol
Molecular Formula C12H21ClO2
Exact Mass 232.123008 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 1EbGS3oK7uR
Name ETHYL-7-CHLORO-3,7-DIMETHYL-(2E)-OCTENOATE
Compound Number 6A
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C12H21ClO2
InChI InChI=1S/C12H21ClO2/c1-5-15-11(14)9-10(2)7-6-8-12(3,4)13/h9H,5-8H2,1-4H3/b10-9+
InChIKey ZRTFTFPNBMPZOH-MDZDMXLPSA-N
Literature Reference Author K.KIMURA,H.NISHIMURA,I.IWATA,J.MIZUTANI
Literature Reference Citation AGR.BIOL.CHEM.,47,1661(1983)
Literature Reference DOI 10.1271/bbb1961.47.1661
Molecular Weight 232.751 g/mol
Solvent CDCl3
Source File Reference UWIR8632