| SpectraBase Spectrum ID |
9MCibElxrsW |
| Name |
2,4,6,8,10,12,14,16-Heptadecaoctaenoic acid, 17-(3-chloro-4-hydroxyphenyl)-, 2-dodecyl-3-hydroxy-5-propylphenyl ester |
| CAS Registry Number |
75013-60-4 |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C44H55ClO4 |
| InChI |
InChI=1S/C44H55ClO4/c1-3-5-6-7-8-9-17-20-23-26-30-39-42(47)35-38(28-4-2)36-43(39)49-44(48)31-27-24-21-18-15-13-11-10-12-14-16-19-22-25-29-37-32-33-41(46)40(45)34-37/h10-16,18-19,21-22,24-25,27,29,31-36,46-47H,3-9,17,20,23,26,28,30H2,1-2H3/b12-10+,13-11+,16-14+,18-15+,22-19+,24-21+,29-25+,31-27- |
| InChIKey |
BPCJJAYJGVPIQV-AEGBEEKXSA-N |
| Molecular Weight |
683.373 g/mol |
| SMILES |
Oc1c(c(OC(\C=C/C=C/C=C/C=C/C=C/C=C/C=C/C=C/c2ccc(c(c2)Cl)O)=O)cc(c1)CCC)CCCCCCCCCCCC |
| SPLASH |
splash10-0673-0931000000-999f1f97673d6f9ed24e |
| Source of Spectrum |
F-37-561-0 |
| Synonyms |
2-Dodecyl-3-hydroxy-5-propylphenyl (2Z,4E,6E,8E,10E,12E,14E,16E)-17-(3-chloro-4-hydroxyphenyl)-2,4,6,8,10,12,14,16-heptadecaoctaenoate
2-Dodecyl-3-hydroxy-5-propylphenylester of 17-(3-chloro-4-hydroxyphenyl-2,4,6,8,10,12,14,16-heptadecaoctaenoic acid |
| Wiley ID |
1414420 |
