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(E)-Diethyl 2-(6-chloro-1-cyclohexyl-2-hexenyl)malonate
SpectraBase Compound ID A2ov2Q3GL5B
InChI InChI=1S/C19H31ClO4/c1-3-23-18(21)17(19(22)24-4-2)16(13-9-6-10-14-20)15-11-7-5-8-12-15/h9,13,15-17H,3-8,10-12,14H2,1-2H3/b13-9+
InChIKey JBRVHQKBUJISCJ-UKTHLTGXSA-N
Mol Weight 358.91 g/mol
Molecular Formula C19H31ClO4
Exact Mass 358.191087 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ELYXHCp5XTc
Name (E)-Diethyl 2-(6-chloro-1-cyclohexyl-2-hexenyl)malonate
Alternate Name(s) Diethyl 2-[(2E)-6-chloro-1-cyclohexyl-2-hexenyl]malonate
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Formula C19H31ClO4
InChI InChI=1S/C19H31ClO4/c1-3-23-18(21)17(19(22)24-4-2)16(13-9-6-10-14-20)15-11-7-5-8-12-15/h9,13,15-17H,3-8,10-12,14H2,1-2H3/b13-9+
InChIKey JBRVHQKBUJISCJ-UKTHLTGXSA-N
Molecular Weight 358.906 g/mol
SMILES C(C(=O)OCC)(C(=O)OCC)C(\C=C\CCCCl)C1CCCCC1
SPLASH splash10-01t9-0930000000-cb3821677aadd3c0a9d0
Source of Spectrum F-52-7213-12
Wiley ID 796653