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Pimelic acid, 3-fluorophenyl undecyl ester
SpectraBase Compound ID CPL1m7BXH9u
InChI InChI=1S/C24H37FO4/c1-2-3-4-5-6-7-8-9-13-19-28-23(26)17-11-10-12-18-24(27)29-22-16-14-15-21(25)20-22/h14-16,20H,2-13,17-19H2,1H3
InChIKey NWIVXDJPOOBFOW-UHFFFAOYSA-N
Mol Weight 408.6 g/mol
Molecular Formula C24H37FO4
Exact Mass 408.267588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4xc9OMhNQG
Name Pimelic acid, 3-fluorophenyl undecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C24H37FO4
InChI InChI=1S/C24H37FO4/c1-2-3-4-5-6-7-8-9-13-19-28-23(26)17-11-10-12-18-24(27)29-22-16-14-15-21(25)20-22/h14-16,20H,2-13,17-19H2,1H3
InChIKey NWIVXDJPOOBFOW-UHFFFAOYSA-N
Molecular Weight 408.554 g/mol
SMILES C(CCCCCC(Oc1cccc(c1)F)=O)(OCCCCCCCCCCC)=O
SPLASH splash10-054p-9610000000-9e346a470565e6001ea0
Source of Spectrum TIPS-2022-374-0
Wiley ID 1821891