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Benzoic acid, 2,4-dichloro-, 4-tert-butylcyclohexyl ester
SpectraBase Compound ID 6XYE5FmLHfl
InChI InChI=1S/C17H22Cl2O2/c1-17(2,3)11-4-7-13(8-5-11)21-16(20)14-9-6-12(18)10-15(14)19/h6,9-11,13H,4-5,7-8H2,1-3H3
InChIKey FWVMHJISOZQWFP-UHFFFAOYSA-N
Mol Weight 329.27 g/mol
Molecular Formula C17H22Cl2O2
Exact Mass 328.099685 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FUjZ8Xaf6x9
Name Benzoic acid, 2,4-dichloro-, 4-tert-butylcyclohexyl ester
Alternate Name(s) (4-tert-butylcyclohexyl) 2,4-bis(chloranyl)benzoate (4-tert-butylcyclohexyl) 2,4-dichlorobenzoate 2,4-Dichlorobenzoic acid (4-tert-butylcyclohexyl) ester
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Formula C17H22Cl2O2
InChI InChI=1S/C17H22Cl2O2/c1-17(2,3)11-4-7-13(8-5-11)21-16(20)14-9-6-12(18)10-15(14)19/h6,9-11,13H,4-5,7-8H2,1-3H3
InChIKey FWVMHJISOZQWFP-UHFFFAOYSA-N
Molecular Weight 329.267 g/mol
SMILES c1(C(OC2CCC(C(C)(C)C)CC2)=O)c(cc(cc1)Cl)Cl
SPLASH splash10-0a59-9300000000-5ad4714bbea2535ce0d5
Source of Spectrum AD-0-2532-0
Wiley ID 1424811