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Pimelic acid, hex-3-yl tridecyl ester
SpectraBase Compound ID CSXQVb1ELhH
InChI InChI=1S/C26H50O4/c1-4-7-8-9-10-11-12-13-14-15-19-23-29-25(27)21-17-16-18-22-26(28)30-24(6-3)20-5-2/h24H,4-23H2,1-3H3
InChIKey NKGQMZHUELGXLY-UHFFFAOYSA-N
Mol Weight 426.7 g/mol
Molecular Formula C26H50O4
Exact Mass 426.37091 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3xc1Y2o3Q7N
Name Pimelic acid, hex-3-yl tridecyl ester
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C26H50O4
InChI InChI=1S/C26H50O4/c1-4-7-8-9-10-11-12-13-14-15-19-23-29-25(27)21-17-16-18-22-26(28)30-24(6-3)20-5-2/h24H,4-23H2,1-3H3
InChIKey NKGQMZHUELGXLY-UHFFFAOYSA-N
Molecular Weight 426.682 g/mol
SMILES C(CCCCCC(OC(CCC)CC)=O)(OCCCCCCCCCCCCC)=O
SPLASH splash10-0006-6900000000-ab78eb1944f1660bf9cd
Source of Spectrum TIPS-2022-967-0
Wiley ID 1822484