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Pimelic acid, (2-naphthyl)methyl pentyl ester

View entire compound with spectra: 1 MS (GC)

Pimelic acid, (2-naphthyl)methyl pentyl ester
SpectraBase Compound ID FmweNaPhDan
InChI InChI=1S/C23H30O4/c1-2-3-9-16-26-22(24)12-5-4-6-13-23(25)27-18-19-14-15-20-10-7-8-11-21(20)17-19/h7-8,10-11,14-15,17H,2-6,9,12-13,16,18H2,1H3
InChIKey KWGPOKNKESREAB-UHFFFAOYSA-N
Mol Weight 370.49 g/mol
Molecular Formula C23H30O4
Exact Mass 370.214409 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KDB03MG7Gbl
Name Pimelic acid, (2-naphthyl)methyl pentyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C23H30O4
InChI InChI=1S/C23H30O4/c1-2-3-9-16-26-22(24)12-5-4-6-13-23(25)27-18-19-14-15-20-10-7-8-11-21(20)17-19/h7-8,10-11,14-15,17H,2-6,9,12-13,16,18H2,1H3
InChIKey KWGPOKNKESREAB-UHFFFAOYSA-N
Molecular Weight 370.489 g/mol
SMILES C(CCCCCC(OCc1cc2c(cc1)cccc2)=O)(OCCCCC)=O
SPLASH splash10-052f-2900000000-57272ae645aff8d45717
Source of Spectrum TIPS-2022-464-0
Wiley ID 1821981