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Benzoic acid, 3,5-dichloro-2,4-dimethoxy-6-pentyl-, 3-methoxy-4-(methoxycarbonyl)-5-pentylphenyl ester
SpectraBase Compound ID 5NY8laPaTEZ
InChI InChI=1S/C28H36Cl2O7/c1-7-9-11-13-17-15-18(16-20(33-3)21(17)27(31)36-6)37-28(32)22-19(14-12-10-8-2)23(29)26(35-5)24(30)25(22)34-4/h15-16H,7-14H2,1-6H3
InChIKey UVYGBRWNWAONPA-UHFFFAOYSA-N
Mol Weight 555.5 g/mol
Molecular Formula C28H36Cl2O7
Exact Mass 554.183809 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DDEbIMtDkSj
Name Benzoic acid, 3,5-dichloro-2,4-dimethoxy-6-pentyl-, 3-methoxy-4-(methoxycarbonyl)-5-pentylphenyl ester
CAS Registry Number 64185-28-0
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C28H36Cl2O7
InChI InChI=1S/C28H36Cl2O7/c1-7-9-11-13-17-15-18(16-20(33-3)21(17)27(31)36-6)37-28(32)22-19(14-12-10-8-2)23(29)26(35-5)24(30)25(22)34-4/h15-16H,7-14H2,1-6H3
InChIKey UVYGBRWNWAONPA-UHFFFAOYSA-N
Molecular Weight 555.495 g/mol
SMILES c1(C(Oc2cc(OC)c(c(c2)CCCCC)C(=O)OC)=O)c(c(Cl)c(c(c1CCCCC)Cl)OC)OC
SPLASH splash10-0pw9-0039010000-5c13ead234fc4ff788cc
Source of Spectrum W5-37439-28097-28097
Synonyms 3-Methoxy-4-(methoxycarbonyl)-5-pentylphenyl 3,5-dichloro-2,4-dimethoxy-6-pentylbenzoate 3,5-Dichloro-2,4-dimethoxy-6-pentylbenzoic acid (3-methoxy-4-methoxycarbonyl-5-pentylphenyl) ester (3-methoxy-4-methoxycarbonyl-5-pentylphenyl) 3,5-dichloro-2,4-dimethoxy-6-pentylbenzoate (3-methoxy-4-methoxycarbonyl-5-pentyl-phenyl) 3,5-dichloro-2,4-dimethoxy-6-pentyl-benzoate (3-methoxy-4-methoxycarbonyl-5-pentyl-phenyl) 3,5-bis(chloranyl)-2,4-dimethoxy-6-pentyl-benzoate
Wiley ID 1406190