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cis-Cyclohex-4-en-1,2-dicarboxylic acid, isopropyl hexyl ester
SpectraBase Compound ID DHMvxx99i9s
InChI InChI=1S/C17H28O4/c1-4-5-6-9-12-20-16(18)14-10-7-8-11-15(14)17(19)21-13(2)3/h7-8,13-15H,4-6,9-12H2,1-3H3
InChIKey BSFHJFJETUVJEU-UHFFFAOYSA-N
Mol Weight 296.41 g/mol
Molecular Formula C17H28O4
Exact Mass 296.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DYeeFghAxa7
Name cis-Cyclohex-4-en-1,2-dicarboxylic acid, isopropyl hexyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H28O4
InChI InChI=1S/C17H28O4/c1-4-5-6-9-12-20-16(18)14-10-7-8-11-15(14)17(19)21-13(2)3/h7-8,13-15H,4-6,9-12H2,1-3H3
InChIKey BSFHJFJETUVJEU-UHFFFAOYSA-N
Molecular Weight 296.407 g/mol
SMILES C1C(C(CC=C1)C(OCCCCCC)=O)C(OC(C)C)=O
SPLASH splash10-0fmi-9810000000-197e26f6cdb440e58ce1
Source of Spectrum TIPS-2023-846-0
Wiley ID 1885552