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2-(octyl)decane-1,10-dioic acid (dimethyl ester)
SpectraBase Compound ID 97V1T847oJT
InChI InChI=1S/C20H38O4/c1-4-5-6-7-9-12-15-18(20(22)24-3)16-13-10-8-11-14-17-19(21)23-2/h18H,4-17H2,1-3H3
InChIKey DBGLRHFEEVBAIS-UHFFFAOYSA-N
Mol Weight 342.5 g/mol
Molecular Formula C20H38O4
Exact Mass 342.27701 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6GD3swAySzr
Name 2-(octyl)decane-1,10-dioic acid (dimethyl ester)
Alternate Name(s) Graminoxin B Dimethyl 2-octyldecanedioate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H38O4
InChI InChI=1S/C20H38O4/c1-4-5-6-7-9-12-15-18(20(22)24-3)16-13-10-8-11-14-17-19(21)23-2/h18H,4-17H2,1-3H3
InChIKey DBGLRHFEEVBAIS-UHFFFAOYSA-N
Literature Reference DOI 10.1002/open.201800045
Molecular Weight 342.520 g/mol
SMILES CCCCCCCCC(CCCCCCCC(OC)=O)C(OC)=O
SPLASH splash10-00ks-9810000000-0d8b83f50d822081d50a
Source of Spectrum CHO-7-SM2-16
Wiley ID 1813790