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Pimelic acid, (2-naphthyl)methyl octyl ester

View entire compound with spectra: 1 MS (GC)

Pimelic acid, (2-naphthyl)methyl octyl ester
SpectraBase Compound ID EmtqYAw07BT
InChI InChI=1S/C26H36O4/c1-2-3-4-5-6-12-19-29-25(27)15-8-7-9-16-26(28)30-21-22-17-18-23-13-10-11-14-24(23)20-22/h10-11,13-14,17-18,20H,2-9,12,15-16,19,21H2,1H3
InChIKey YNAPWALKKMOWBE-UHFFFAOYSA-N
Mol Weight 412.6 g/mol
Molecular Formula C26H36O4
Exact Mass 412.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1MgcfSV7c2W
Name Pimelic acid, (2-naphthyl)methyl octyl ester
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H36O4
InChI InChI=1S/C26H36O4/c1-2-3-4-5-6-12-19-29-25(27)15-8-7-9-16-26(28)30-21-22-17-18-23-13-10-11-14-24(23)20-22/h10-11,13-14,17-18,20H,2-9,12,15-16,19,21H2,1H3
InChIKey YNAPWALKKMOWBE-UHFFFAOYSA-N
Molecular Weight 412.570 g/mol
SMILES C(CCCCCC(OCc1cc2c(cc1)cccc2)=O)(OCCCCCCCC)=O
SPLASH splash10-052f-1900000000-b94216df0515eef9e2a5
Source of Spectrum TIPS-2022-468-0
Wiley ID 1821985