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Benzoic acid, 4-(acetyloxy)-, 4-[(4-pentylphenoxy)carbonyl]phenyl ester
SpectraBase Compound ID 4798AFQBImW
InChI InChI=1S/C27H26O6/c1-3-4-5-6-20-7-13-24(14-8-20)32-26(29)22-11-17-25(18-12-22)33-27(30)21-9-15-23(16-10-21)31-19(2)28/h7-18H,3-6H2,1-2H3
InChIKey JNTZRWGGOSTEAX-UHFFFAOYSA-N
Mol Weight 446.5 g/mol
Molecular Formula C27H26O6
Exact Mass 446.172939 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 957GLLjIQ7w
Name Benzoic acid, 4-(acetyloxy)-, 4-[(4-pentylphenoxy)carbonyl]phenyl ester
Alternate Name(s) 4-((4-pentylphenoxy)carbonyl)phenyl 4-acetoxybenzoate 4-[(4-pentylphenoxy)carbonyl]phenyl 4-(acetyloxy)benzoate 4-Acetyloxybenzoic acid [4-[oxo-(4-pentylphenoxy)methyl]phenyl] ester [4-(4-pentylphenoxy)carbonylphenyl] 4-acetoxybenzoate [4-(4-pentylphenoxy)carbonylphenyl] 4-acetyloxybenzoate
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Formula C27H26O6
InChI InChI=1S/C27H26O6/c1-3-4-5-6-20-7-13-24(14-8-20)32-26(29)22-11-17-25(18-12-22)33-27(30)21-9-15-23(16-10-21)31-19(2)28/h7-18H,3-6H2,1-2H3
InChIKey JNTZRWGGOSTEAX-UHFFFAOYSA-N
Molecular Weight 446.499 g/mol
SMILES CCCCCc1ccc(OC(=O)c2ccc(OC(=O)c3ccc(OC(C)=O)cc3)cc2)cc1
SPLASH splash10-0230-4940000000-edf45c6f5afc4b60a4f6
Source of Spectrum JX-2015-4-568
Wiley ID 1725998