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Pimelic acid, (2-naphthyl)methyl butyl ester

View entire compound with spectra: 1 MS (GC)

Pimelic acid, (2-naphthyl)methyl butyl ester
SpectraBase Compound ID LiHtF1qv2dH
InChI InChI=1S/C22H28O4/c1-2-3-15-25-21(23)11-5-4-6-12-22(24)26-17-18-13-14-19-9-7-8-10-20(19)16-18/h7-10,13-14,16H,2-6,11-12,15,17H2,1H3
InChIKey SVJJWXPTXYNDNI-UHFFFAOYSA-N
Mol Weight 356.46 g/mol
Molecular Formula C22H28O4
Exact Mass 356.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9X4sT22hTxp
Name Pimelic acid, (2-naphthyl)methyl butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H28O4
InChI InChI=1S/C22H28O4/c1-2-3-15-25-21(23)11-5-4-6-12-22(24)26-17-18-13-14-19-9-7-8-10-20(19)16-18/h7-10,13-14,16H,2-6,11-12,15,17H2,1H3
InChIKey SVJJWXPTXYNDNI-UHFFFAOYSA-N
Molecular Weight 356.462 g/mol
SMILES C(CCCCCC(OCc1cc2c(cc1)cccc2)=O)(OCCCC)=O
SPLASH splash10-052f-1900000000-30b8172c3e2253ba91f8
Source of Spectrum TIPS-2022-463-0
Wiley ID 1821980