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4-CHLORO-1,3,5-TRIMETHYL-4-NITRO-CYCLOHEXA-2,5-DIENYL-ACETATE;(DIASTEREOMER-1)
SpectraBase Compound ID GTDY0MPq9kT
InChI InChI=1S/C11H14ClNO4/c1-7-5-10(4,17-9(3)14)6-8(2)11(7,12)13(15)16/h5-6H,1-4H3
InChIKey JREYRDIHTVMKDP-UHFFFAOYSA-N
Mol Weight 259.69 g/mol
Molecular Formula C11H14ClNO4
Exact Mass 259.061136 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID IURk4P6fWbG
Name 4-CHLORO-1,3,5-TRIMETHYL-4-NITRO-CYCLOHEXA-2,5-DIENYL-ACETATE;(DIASTEREOMER-1)
Copyright Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Formula C11H14ClNO4
InChI InChI=1S/C11H14ClNO4/c1-7-5-10(4,17-9(3)14)6-8(2)11(7,12)13(15)16/h5-6H,1-4H3
InChIKey JREYRDIHTVMKDP-UHFFFAOYSA-N
Literature Reference Author A.FISCHER,S.S.SEYAN
Literature Reference Citation CAN.J.CHEM.,56,1348(1978)
Literature Reference DOI 10.1139/v78-223
Molecular Weight 259.689 g/mol
Solvent CDCl3
Source File Reference UWED4870