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Pimelic acid, 3-ethylphenyl nonyl ester
SpectraBase Compound ID gr5rZCJknJ
InChI InChI=1S/C24H38O4/c1-3-5-6-7-8-9-13-19-27-23(25)17-11-10-12-18-24(26)28-22-16-14-15-21(4-2)20-22/h14-16,20H,3-13,17-19H2,1-2H3
InChIKey OQSTUQJHHLFDCC-UHFFFAOYSA-N
Mol Weight 390.6 g/mol
Molecular Formula C24H38O4
Exact Mass 390.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B3o8egd9iMK
Name Pimelic acid, 3-ethylphenyl nonyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H38O4
InChI InChI=1S/C24H38O4/c1-3-5-6-7-8-9-13-19-27-23(25)17-11-10-12-18-24(26)28-22-16-14-15-21(4-2)20-22/h14-16,20H,3-13,17-19H2,1-2H3
InChIKey OQSTUQJHHLFDCC-UHFFFAOYSA-N
Molecular Weight 390.564 g/mol
SMILES C(CCCCCC(Oc1cccc(c1)CC)=O)(OCCCCCCCCC)=O
SPLASH splash10-00dl-6910000000-9196e9f82c8b5fda90dc
Source of Spectrum TIPS-2022-493-0
Wiley ID 1822010