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cis-Cyclohex-4-en-1,2-dicarboxylic acid, dodecyl heptyl ester
SpectraBase Compound ID 9FehKlJ8cCn
InChI InChI=1S/C27H48O4/c1-3-5-7-9-10-11-12-13-15-19-23-31-27(29)25-21-17-16-20-24(25)26(28)30-22-18-14-8-6-4-2/h16-17,24-25H,3-15,18-23H2,1-2H3
InChIKey XGPAWRRPXJMSRZ-UHFFFAOYSA-N
Mol Weight 436.7 g/mol
Molecular Formula C27H48O4
Exact Mass 436.35526 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID y2L6OebFI1
Name cis-Cyclohex-4-en-1,2-dicarboxylic acid, dodecyl heptyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H48O4
InChI InChI=1S/C27H48O4/c1-3-5-7-9-10-11-12-13-15-19-23-31-27(29)25-21-17-16-20-24(25)26(28)30-22-18-14-8-6-4-2/h16-17,24-25H,3-15,18-23H2,1-2H3
InChIKey XGPAWRRPXJMSRZ-UHFFFAOYSA-N
Molecular Weight 436.677 g/mol
SMILES C1C(C(CC=C1)C(OCCCCCCC)=O)C(OCCCCCCCCCCCC)=O
SPLASH splash10-00fr-9720000000-ffaad8ef586310faf8d3
Source of Spectrum TIPS-2023-816-0
Wiley ID 1885522