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Pimelic acid, 4-heptyl ester
SpectraBase Compound ID 9Bn3blWqHn9
InChI InChI=1S/C14H26O4/c1-3-8-12(9-4-2)18-14(17)11-7-5-6-10-13(15)16/h12H,3-11H2,1-2H3,(H,15,16)
InChIKey HMBAKGDPVDTPMM-UHFFFAOYSA-N
Mol Weight 258.36 g/mol
Molecular Formula C14H26O4
Exact Mass 258.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID Fhkf0Ueh4sY
Name Pimelic acid, 4-heptyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H26O4
InChI InChI=1S/C14H26O4/c1-3-8-12(9-4-2)18-14(17)11-7-5-6-10-13(15)16/h12H,3-11H2,1-2H3,(H,15,16)
InChIKey HMBAKGDPVDTPMM-UHFFFAOYSA-N
Molecular Weight 258.358 g/mol
SMILES OC(CCCCCC(OC(CCC)CCC)=O)=O
SPLASH splash10-0006-7900000000-f879cddac2e3025b7030
Source of Spectrum TIPS-2022-835-0
Wiley ID 1822352