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Phthalic acid, neopentyl 2-pentyl ester
SpectraBase Compound ID DuZGmqaov25
InChI InChI=1S/C18H26O4/c1-6-9-13(2)22-17(20)15-11-8-7-10-14(15)16(19)21-12-18(3,4)5/h7-8,10-11,13H,6,9,12H2,1-5H3
InChIKey RDFBYSKHOQYCTH-UHFFFAOYSA-N
Mol Weight 306.4 g/mol
Molecular Formula C18H26O4
Exact Mass 306.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2JJiXZ4Jsgy
Name Phthalic acid, neopentyl 2-pentyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O4
InChI InChI=1S/C18H26O4/c1-6-9-13(2)22-17(20)15-11-8-7-10-14(15)16(19)21-12-18(3,4)5/h7-8,10-11,13H,6,9,12H2,1-5H3
InChIKey RDFBYSKHOQYCTH-UHFFFAOYSA-N
Molecular Weight 306.402 g/mol
SMILES c1c(c(ccc1)C(OC(C)CCC)=O)C(OCC(C)(C)C)=O
SPLASH splash10-0002-2910000000-2599679927a40ce44a2f
Source of Spectrum NP-10-4533-0
Synonyms benzene-1,2-dicarboxylic acid O1-(2,2-dimethylpropyl) ester O2-pentan-2-yl ester 1-O-(2,2-dimethylpropyl) 2-O-pentan-2-yl benzene-1,2-dicarboxylate O1-(2,2-dimethylpropyl) O2-(1-methylbutyl) benzene-1,2-dicarboxylate O1-(2,2-dimethylpropyl) O2-pentan-2-yl benzene-1,2-dicarboxylate
Wiley ID 1108907