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Pimelic acid, 2-propylphenyl octyl ester
SpectraBase Compound ID 2x4j7U4mtJD
InChI InChI=1S/C24H38O4/c1-3-5-6-7-8-14-20-27-23(25)18-10-9-11-19-24(26)28-22-17-13-12-16-21(22)15-4-2/h12-13,16-17H,3-11,14-15,18-20H2,1-2H3
InChIKey ZPUWYJJKAUQWDF-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 HPB7X7jOL4i
Name Pimelic acid, 2-propylphenyl octyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H38O4
InChI InChI=1S/C24H38O4/c1-3-5-6-7-8-14-20-27-23(25)18-10-9-11-19-24(26)28-22-17-13-12-16-21(22)15-4-2/h12-13,16-17H,3-11,14-15,18-20H2,1-2H3
InChIKey ZPUWYJJKAUQWDF-UHFFFAOYSA-N
Molecular Weight 390.564 g/mol
SMILES C(CCCCCC(Oc1c(cccc1)CCC)=O)(OCCCCCCCC)=O
SPLASH splash10-0a73-6910000000-f32c21dfdced36ad7294
Source of Spectrum TIPS-2022-413-0
Wiley ID 1821930