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Phthalic acid, 2-chlorophenyl neopentyl ester
SpectraBase Compound ID 72RiqtSk51j
InChI InChI=1S/C19H19ClO4/c1-19(2,3)12-23-17(21)13-8-4-5-9-14(13)18(22)24-16-11-7-6-10-15(16)20/h4-11H,12H2,1-3H3
InChIKey WQCUWNNXGRBWTQ-UHFFFAOYSA-N
Mol Weight 346.81 g/mol
Molecular Formula C19H19ClO4
Exact Mass 346.097187 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4q0rpm4jP6N
Name Phthalic acid, 2-chlorophenyl neopentyl ester
Alternate Name(s) benzene-1,2-dicarboxylic acid O2-(2-chlorophenyl) ester O1-(2,2-dimethylpropyl) ester 2-O-(2-chlorophenyl) 1-O-(2,2-dimethylpropyl) benzene-1,2-dicarboxylate O2-(2-chlorophenyl) O1-(2,2-dimethylpropyl) benzene-1,2-dicarboxylate
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Formula C19H19ClO4
InChI InChI=1S/C19H19ClO4/c1-19(2,3)12-23-17(21)13-8-4-5-9-14(13)18(22)24-16-11-7-6-10-15(16)20/h4-11H,12H2,1-3H3
InChIKey WQCUWNNXGRBWTQ-UHFFFAOYSA-N
Molecular Weight 346.810 g/mol
SMILES c1(c(cccc1)C(OCC(C)(C)C)=O)C(Oc1ccccc1Cl)=O
SPLASH splash10-0592-7940000000-675e8f79f87c47ee1b5c
Source of Spectrum NP-12-5285-0
Wiley ID 1110382