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Pimelic acid, 2-methylpent-3-yl 4-methylpent-2-yl ester
SpectraBase Compound ID pVyWtU5zDo
InChI InChI=1S/C19H36O4/c1-7-17(15(4)5)23-19(21)12-10-8-9-11-18(20)22-16(6)13-14(2)3/h14-17H,7-13H2,1-6H3
InChIKey IXNUHZQJGVCZRF-UHFFFAOYSA-N
Mol Weight 328.5 g/mol
Molecular Formula C19H36O4
Exact Mass 328.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3FcJJCZgSwL
Name Pimelic acid, 2-methylpent-3-yl 4-methylpent-2-yl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H36O4
InChI InChI=1S/C19H36O4/c1-7-17(15(4)5)23-19(21)12-10-8-9-11-18(20)22-16(6)13-14(2)3/h14-17H,7-13H2,1-6H3
InChIKey IXNUHZQJGVCZRF-UHFFFAOYSA-N
Molecular Weight 328.493 g/mol
SMILES C(CCCCCC(OC(CC)C(C)C)=O)(OC(CC(C)C)C)=O
SPLASH splash10-0006-6900000000-2edc8ec0779f38d3e272
Source of Spectrum TIPS-2022-874-0
Wiley ID 1822391