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Pimelic acid, 3-ethylphenyl butyl ester
SpectraBase Compound ID 6bGecpOpRDH
InChI InChI=1S/C19H28O4/c1-3-5-14-22-18(20)12-7-6-8-13-19(21)23-17-11-9-10-16(4-2)15-17/h9-11,15H,3-8,12-14H2,1-2H3
InChIKey CCDASCOLLDYXSE-UHFFFAOYSA-N
Mol Weight 320.43 g/mol
Molecular Formula C19H28O4
Exact Mass 320.198759 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fy0z5UcDUkV
Name Pimelic acid, 3-ethylphenyl butyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H28O4
InChI InChI=1S/C19H28O4/c1-3-5-14-22-18(20)12-7-6-8-13-19(21)23-17-11-9-10-16(4-2)15-17/h9-11,15H,3-8,12-14H2,1-2H3
InChIKey CCDASCOLLDYXSE-UHFFFAOYSA-N
Molecular Weight 320.429 g/mol
SMILES C(CCCCCC(Oc1cccc(c1)CC)=O)(OCCCC)=O
SPLASH splash10-00fr-5900000000-75bd7d71b79e28e8bdc3
Source of Spectrum TIPS-2022-487-0
Wiley ID 1822004