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benzene-1,3-dicarboxylic acid diamyl ester
SpectraBase Compound ID 1gD19nXxOO5
InChI InChI=1S/C18H26O4/c1-3-5-7-12-21-17(19)15-10-9-11-16(14-15)18(20)22-13-8-6-4-2/h9-11,14H,3-8,12-13H2,1-2H3
InChIKey KHVWJDHBKQEWMR-UHFFFAOYSA-N
Mol Weight 306.4 g/mol
Molecular Formula C18H26O4
Exact Mass 306.183109 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID oXt1C4wca
Name benzene-1,3-dicarboxylic acid diamyl ester
Alternate Name(s) benzene-1,3-dicarboxylic acid dipentyl ester dipentyl benzene-1,3-dicarboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C18H26O4
InChI InChI=1S/C18H26O4/c1-3-5-7-12-21-17(19)15-10-9-11-16(14-15)18(20)22-13-8-6-4-2/h9-11,14H,3-8,12-13H2,1-2H3
InChIKey KHVWJDHBKQEWMR-UHFFFAOYSA-N
Molecular Weight 306.402 g/mol
SMILES C(c1cc(C(=O)OCCCCC)ccc1)(=O)OCCCCC
SPLASH splash10-014r-6980000000-91c619cc53e59e6bdb8a
Source of Spectrum O-20-656-9
Wiley ID 1308234