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cis-Cyclohex-4-en-1,2-dicarboxylic acid, 2-propylpentyl nonyl ester
SpectraBase Compound ID 89AQjP7Ls2M
InChI InChI=1S/C25H44O4/c1-4-7-8-9-10-11-14-19-28-24(26)22-17-12-13-18-23(22)25(27)29-20-21(15-5-2)16-6-3/h12-13,21-23H,4-11,14-20H2,1-3H3
InChIKey GLLXKMWPCCTBJM-UHFFFAOYSA-N
Mol Weight 408.6 g/mol
Molecular Formula C25H44O4
Exact Mass 408.32396 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7hqxIAEE2bu
Name cis-Cyclohex-4-en-1,2-dicarboxylic acid, 2-propylpentyl nonyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C25H44O4
InChI InChI=1S/C25H44O4/c1-4-7-8-9-10-11-14-19-28-24(26)22-17-12-13-18-23(22)25(27)29-20-21(15-5-2)16-6-3/h12-13,21-23H,4-11,14-20H2,1-3H3
InChIKey GLLXKMWPCCTBJM-UHFFFAOYSA-N
Molecular Weight 408.623 g/mol
SMILES C1C(C(CC=C1)C(OCCCCCCCCC)=O)C(OCC(CCC)CCC)=O
SPLASH splash10-0fk9-9710000000-dcad65969086ee0eb83e
Source of Spectrum TIPS-2023-876-0
Wiley ID 1885582