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Pimelic acid, hept-3-yl 4-methylpent-2-yl ester
SpectraBase Compound ID 7WMsk9uK78S
InChI InChI=1S/C20H38O4/c1-6-8-12-18(7-2)24-20(22)14-11-9-10-13-19(21)23-17(5)15-16(3)4/h16-18H,6-15H2,1-5H3
InChIKey WQZRRWNQNBNPSU-UHFFFAOYSA-N
Mol Weight 342.5 g/mol
Molecular Formula C20H38O4
Exact Mass 342.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GqKT0AT1j2b
Name Pimelic acid, hept-3-yl 4-methylpent-2-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H38O4
InChI InChI=1S/C20H38O4/c1-6-8-12-18(7-2)24-20(22)14-11-9-10-13-19(21)23-17(5)15-16(3)4/h16-18H,6-15H2,1-5H3
InChIKey WQZRRWNQNBNPSU-UHFFFAOYSA-N
Molecular Weight 342.520 g/mol
SMILES C(CCCCCC(OC(CCCC)CC)=O)(OC(CC(C)C)C)=O
SPLASH splash10-0006-5900000000-34d7c73e68dfb24848ee
Source of Spectrum TIPS-2022-1017-0
Wiley ID 1822534