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Hexanedioic acid, 2-tridecyl-, dimethyl ester
SpectraBase Compound ID 7rdI2pHqWlh
InChI InChI=1S/C21H40O4/c1-4-5-6-7-8-9-10-11-12-13-14-16-19(21(23)25-3)17-15-18-20(22)24-2/h19H,4-18H2,1-3H3
InChIKey JQFDANWHNAFHTR-UHFFFAOYSA-N
Mol Weight 356.5 g/mol
Molecular Formula C21H40O4
Exact Mass 356.29266 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8HnAEl3yXp7
Name Hexanedioic acid, 2-tridecyl-, dimethyl ester
Alternate Name(s) Dimethyl 2-tridecylhexanedioate 2-tridecyladipic acid dimethyl ester 2-tridecylhexanedioic acid dimethyl ester
CAS Registry Number 41240-31-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H40O4
InChI InChI=1S/C21H40O4/c1-4-5-6-7-8-9-10-11-12-13-14-16-19(21(23)25-3)17-15-18-20(22)24-2/h19H,4-18H2,1-3H3
InChIKey JQFDANWHNAFHTR-UHFFFAOYSA-N
Molecular Weight 356.547 g/mol
SMILES C(C(CCCCCCCCCCCCC)C(OC)=O)CCC(OC)=O
SPLASH splash10-00dl-9720000000-a744a906346d5eebf9c2
Source of Spectrum EP-6147-0-0
Wiley ID 1345987