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2,4-Dimethoxy-6-(2-oxoheptadecyl)benzoic acid methyl ester
SpectraBase Compound ID I905wLxYKuU
InChI InChI=1S/C27H44O5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(28)19-22-20-24(30-2)21-25(31-3)26(22)27(29)32-4/h20-21H,5-19H2,1-4H3
InChIKey MGKXXDKHLZJLQR-UHFFFAOYSA-N
Mol Weight 448.6 g/mol
Molecular Formula C27H44O5
Exact Mass 448.318875 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID B2Mpch5Ob0y
Name 2,4-Dimethoxy-6-(2-oxoheptadecyl)benzoic acid methyl ester
Alternate Name(s) Methyl 2,4-dimethoxy-6-(2-oxoheptadecyl)benzoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H44O5
InChI InChI=1S/C27H44O5/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-23(28)19-22-20-24(30-2)21-25(31-3)26(22)27(29)32-4/h20-21H,5-19H2,1-4H3
InChIKey MGKXXDKHLZJLQR-UHFFFAOYSA-N
Molecular Weight 448.644 g/mol
SMILES C(c1c(cc(cc1CC(CCCCCCCCCCCCCCC)=O)OC)OC)(=O)OC
SPLASH splash10-066r-0250900000-0d8787d28ee420ef514f
Source of Spectrum F7-20-293-3
Wiley ID 1556908