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Hexadecanedioic acid, 3-methyl-, dimethyl ester
SpectraBase Compound ID KrK6bQqCzG6
InChI InChI=1S/C19H36O4/c1-17(16-19(21)23-3)14-12-10-8-6-4-5-7-9-11-13-15-18(20)22-2/h17H,4-16H2,1-3H3
InChIKey ZQHYRIPZULFTKZ-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 ANC1rCssZtm
Name Hexadecanedioic acid, 3-methyl-, dimethyl ester
Alternate Name(s) Dimethyl 3-methylhexadecanedioate 3-Methylhexadecanedioic acid dimethyl ester 3-Methylthapsic acid dimethyl ester
CAS Registry Number 55334-52-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H36O4
InChI InChI=1S/C19H36O4/c1-17(16-19(21)23-3)14-12-10-8-6-4-5-7-9-11-13-15-18(20)22-2/h17H,4-16H2,1-3H3
InChIKey ZQHYRIPZULFTKZ-UHFFFAOYSA-N
Molecular Weight 328.493 g/mol
SMILES C(C(CC(OC)=O)C)CCCCCCCCCCCC(OC)=O
SPLASH splash10-006t-9640000000-419fa1951d730469b3d4
Source of Spectrum AD-0-1888-0
Wiley ID 48949