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Benzoic acid, 4-pentyl-, 4-(1-oxopentyl)phenyl ester
SpectraBase Compound ID 2J35MdEwqzc
InChI InChI=1S/C23H28O3/c1-3-5-7-8-18-10-12-20(13-11-18)23(25)26-21-16-14-19(15-17-21)22(24)9-6-4-2/h10-17H,3-9H2,1-2H3
InChIKey JINUMHRORJULKP-UHFFFAOYSA-N
Mol Weight 352.47 g/mol
Molecular Formula C23H28O3
Exact Mass 352.203845 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9Zx6qs0vgVw
Name Benzoic acid, 4-pentyl-, 4-(1-oxopentyl)phenyl ester
Alternate Name(s) 4-Pentanoylphenyl 4-pentylbenzoate 4-Pentylbenzoic acid [4-(1-oxopentyl)phenyl] ester (4-pentanoylphenyl) 4-pentylbenzoate
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Formula C23H28O3
InChI InChI=1S/C23H28O3/c1-3-5-7-8-18-10-12-20(13-11-18)23(25)26-21-16-14-19(15-17-21)22(24)9-6-4-2/h10-17H,3-9H2,1-2H3
InChIKey JINUMHRORJULKP-UHFFFAOYSA-N
Molecular Weight 352.474 g/mol
SMILES CCCCCc1ccc(cc1)C(=O)Oc1ccc(cc1)C(=O)CCCC
SPLASH splash10-004i-5900000000-eb3f5f6b5c1a1c71f266
Source of Spectrum JX-2015-3-1122
Wiley ID 1724634