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Phthalic acid, decyl hex-2-yn-4-yl ester
SpectraBase Compound ID FMg4Xf2WrlO
InChI InChI=1S/C24H34O4/c1-4-7-8-9-10-11-12-15-19-27-23(25)21-17-13-14-18-22(21)24(26)28-20(6-3)16-5-2/h13-14,17-18,20H,4,6-12,15,19H2,1-3H3
InChIKey MMQCOXCEKYGUSD-UHFFFAOYSA-N
Mol Weight 386.5 g/mol
Molecular Formula C24H34O4
Exact Mass 386.24571 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fws1i68DKpN
Name Phthalic acid, decyl hex-2-yn-4-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H34O4
InChI InChI=1S/C24H34O4/c1-4-7-8-9-10-11-12-15-19-27-23(25)21-17-13-14-18-22(21)24(26)28-20(6-3)16-5-2/h13-14,17-18,20H,4,6-12,15,19H2,1-3H3
InChIKey MMQCOXCEKYGUSD-UHFFFAOYSA-N
Molecular Weight 386.532 g/mol
SMILES C(c1c(cccc1)C(=O)OCCCCCCCCCC)(OC(CC)C#CC)=O
SPLASH splash10-0002-3900000000-8e0564a36a63f5ad333b
Source of Spectrum NP-14-952-0
Synonyms benzene-1,2-dicarboxylic acid O1-decyl ester O2-hex-4-yn-3-yl ester 1-O-decyl 2-O-hex-4-yn-3-yl benzene-1,2-dicarboxylate O1-decyl O2-(1-ethylbut-2-ynyl) benzene-1,2-dicarboxylate O1-decyl O2-hex-4-yn-3-yl benzene-1,2-dicarboxylate
Wiley ID 1111521