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(E)-Trimethyl 2-cyanocyclopropane-3-(4-chlorophenyl)-1,1,2-tricarboxylate
SpectraBase Compound ID 6gApOY3JeJ9
InChI InChI=1S/C16H14ClNO6/c1-22-12(19)15(8-18)11(9-4-6-10(17)7-5-9)16(15,13(20)23-2)14(21)24-3/h4-7,11H,1-3H3/t11-,15+/m0/s1
InChIKey SHEDHOSDBVGZEX-XHDPSFHLSA-N
Mol Weight 351.74 g/mol
Molecular Formula C16H14ClNO6
Exact Mass 351.050965 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FfeQl9786Dv
Name (E)-Trimethyl 2-cyanocyclopropane-3-(4-chlorophenyl)-1,1,2-tricarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H14ClNO6
InChI InChI=1S/C16H14ClNO6/c1-22-12(19)15(8-18)11(9-4-6-10(17)7-5-9)16(15,13(20)23-2)14(21)24-3/h4-7,11H,1-3H3/t11-,15+/m0/s1
InChIKey SHEDHOSDBVGZEX-XHDPSFHLSA-N
Molecular Weight 351.742 g/mol
SMILES C1([C@](C(=O)OC)(C#N)[C@@]1(c1ccc(cc1)Cl)[H])(C(=O)OC)C(=O)OC
SPLASH splash10-0a4l-7491000000-76d400d18991e5375573
Source of Spectrum F-62-3995-3
Wiley ID 1633025