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cis-Cyclohex-4-en-1,2-dicarboxylic acid, 2,4,4-trimethylpentyl octyl ester
SpectraBase Compound ID FTQp3ZlHlzy
InChI InChI=1S/C24H42O4/c1-6-7-8-9-10-13-16-27-22(25)20-14-11-12-15-21(20)23(26)28-18-19(2)17-24(3,4)5/h11-12,19-21H,6-10,13-18H2,1-5H3
InChIKey CWPFTGCUXJYDKF-UHFFFAOYSA-N
Mol Weight 394.6 g/mol
Molecular Formula C24H42O4
Exact Mass 394.30831 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5faoqX27gRf
Name cis-Cyclohex-4-en-1,2-dicarboxylic acid, 2,4,4-trimethylpentyl octyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H42O4
InChI InChI=1S/C24H42O4/c1-6-7-8-9-10-13-16-27-22(25)20-14-11-12-15-21(20)23(26)28-18-19(2)17-24(3,4)5/h11-12,19-21H,6-10,13-18H2,1-5H3
InChIKey CWPFTGCUXJYDKF-UHFFFAOYSA-N
Molecular Weight 394.596 g/mol
SMILES C1C(C(CC=C1)C(OCCCCCCCC)=O)C(OCC(CC(C)(C)C)C)=O
SPLASH splash10-0kmi-9510000000-3eb1ebcae6856631b485
Source of Spectrum TIPS-2023-889-0
Wiley ID 1885595