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Phthalic acid, 2,7-dimethyloct-7-en-5-yn-4-yl hexyl ester
SpectraBase Compound ID 4mhqfEJDx1h
InChI InChI=1S/C24H32O4/c1-6-7-8-11-16-27-23(25)21-12-9-10-13-22(21)24(26)28-20(17-19(4)5)15-14-18(2)3/h9-10,12-13,19-20H,2,6-8,11,16-17H2,1,3-5H3
InChIKey HDYKVFQHYXMJTB-UHFFFAOYSA-N
Mol Weight 384.5 g/mol
Molecular Formula C24H32O4
Exact Mass 384.23006 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7y55PjiwE59
Name Phthalic acid, 2,7-dimethyloct-7-en-5-yn-4-yl hexyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H32O4
InChI InChI=1S/C24H32O4/c1-6-7-8-11-16-27-23(25)21-12-9-10-13-22(21)24(26)28-20(17-19(4)5)15-14-18(2)3/h9-10,12-13,19-20H,2,6-8,11,16-17H2,1,3-5H3
InChIKey HDYKVFQHYXMJTB-UHFFFAOYSA-N
Molecular Weight 384.516 g/mol
SMILES C(CCOC(c1c(cccc1)C(OC(CC(C)C)C#CC(C)=C)=O)=O)CCC
SPLASH splash10-0002-2900000000-ce8b4b4203e378633d82
Source of Spectrum NP-14-285-0
Synonyms benzene-1,2-dicarboxylic acid O2-(2,7-dimethyloct-7-en-5-yn-4-yl) ester O1-hexyl ester 2-O-(2,7-dimethyloct-7-en-5-yn-4-yl) 1-O-hexyl benzene-1,2-dicarboxylate O1-hexyl O2-(1-isobutyl-4-methyl-pent-4-en-2-ynyl) benzene-1,2-dicarboxylate O2-(2,7-dimethyloct-7-en-5-yn-4-yl) O1-hexyl benzene-1,2-dicarboxylate
Wiley ID 1111463