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Phthalic acid, 4-chlorophenyl neopentyl ester
SpectraBase Compound ID 6MIhImiAQod
InChI InChI=1S/C19H19ClO4/c1-19(2,3)12-23-17(21)15-6-4-5-7-16(15)18(22)24-14-10-8-13(20)9-11-14/h4-11H,12H2,1-3H3
InChIKey CHGGYYLNVBNDCS-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 B2xW8DbDpey
Name Phthalic acid, 4-chlorophenyl neopentyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H19ClO4
InChI InChI=1S/C19H19ClO4/c1-19(2,3)12-23-17(21)15-6-4-5-7-16(15)18(22)24-14-10-8-13(20)9-11-14/h4-11H,12H2,1-3H3
InChIKey CHGGYYLNVBNDCS-UHFFFAOYSA-N
Molecular Weight 346.810 g/mol
SMILES c1c(c(ccc1)C(Oc1ccc(cc1)Cl)=O)C(OCC(C)(C)C)=O
SPLASH splash10-006t-6930000000-afc80ed85cd38e30cfbc
Source of Spectrum NP-12-5283-0
Synonyms benzene-1,2-dicarboxylic acid O2-(4-chlorophenyl) ester O1-(2,2-dimethylpropyl) ester 2-O-(4-chlorophenyl) 1-O-(2,2-dimethylpropyl) benzene-1,2-dicarboxylate O2-(4-chlorophenyl) O1-(2,2-dimethylpropyl) benzene-1,2-dicarboxylate
Wiley ID 1110381