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Benzoic acid, 2-chloro-, 2-isopropyl-4-methylphenyl ester
SpectraBase Compound ID 4dWxYips3mJ
InChI InChI=1S/C17H17ClO2/c1-11(2)14-10-12(3)8-9-16(14)20-17(19)13-6-4-5-7-15(13)18/h4-11H,1-3H3
InChIKey PLNBTNDQLVLXNJ-UHFFFAOYSA-N
Mol Weight 288.77 g/mol
Molecular Formula C17H17ClO2
Exact Mass 288.091707 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5bYQCTJmLZh
Name Benzoic acid, 2-chloro-, 2-isopropyl-4-methylphenyl ester
Alternate Name(s) (2-isopropyl-4-methyl-phenyl) 2-chlorobenzoate (4-methyl-2-propan-2-yl-phenyl) 2-chloranylbenzoate (4-methyl-2-propan-2-ylphenyl) 2-chlorobenzoate 2-Chlorobenzoic acid (2-isopropyl-4-methyl-phenyl) ester 2-Chlorobenzoic acid (4-methyl-2-propan-2-ylphenyl) ester
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Formula C17H17ClO2
InChI InChI=1S/C17H17ClO2/c1-11(2)14-10-12(3)8-9-16(14)20-17(19)13-6-4-5-7-15(13)18/h4-11H,1-3H3
InChIKey PLNBTNDQLVLXNJ-UHFFFAOYSA-N
Molecular Weight 288.774 g/mol
SMILES c1(C(Oc2c(cc(cc2)C)C(C)C)=O)ccccc1Cl
SPLASH splash10-000i-7900000000-51a4ccc192866c1ffbbe
Source of Spectrum AD-0-2532-0
Wiley ID 1419776