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1,13-Diphenyltridecane-4,10-dicarboxylic acid
SpectraBase Compound ID EYkTw2OqpoY
InChI InChI=1S/C27H36O4/c28-26(29)24(20-10-16-22-12-4-1-5-13-22)18-8-3-9-19-25(27(30)31)21-11-17-23-14-6-2-7-15-23/h1-2,4-7,12-15,24-25H,3,8-11,16-21H2,(H,28,29)(H,30,31)
InChIKey SIFMKXDQOUTGGO-UHFFFAOYSA-N
Mol Weight 424.6 g/mol
Molecular Formula C27H36O4
Exact Mass 424.26136 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5zwpOFcvc7K
Name 1,13-Diphenyltridecane-4,10-dicarboxylic acid
Alternate Name(s) 2,8-bis(3-phenylpropyl)nonanedioic acid
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C27H36O4
InChI InChI=1S/C27H36O4/c28-26(29)24(20-10-16-22-12-4-1-5-13-22)18-8-3-9-19-25(27(30)31)21-11-17-23-14-6-2-7-15-23/h1-2,4-7,12-15,24-25H,3,8-11,16-21H2,(H,28,29)(H,30,31)
InChIKey SIFMKXDQOUTGGO-UHFFFAOYSA-N
Literature Reference DOI 10.1002/ardp.19903230210
Molecular Weight 424.581 g/mol
SMILES OC(C(CCCCCC(C(=O)O)CCCc1ccccc1)CCCc1ccccc1)=O
SPLASH splash10-01p6-4903000000-0cfc09a74360ca66b9a2
Source of Spectrum APC-323-105-4c
Wiley ID 1798948