| SpectraBase Spectrum ID |
6tyHP3H1rKw |
| Name |
benzyl 4-[2'-hydroxy-4'-methoxy-6'-(2''-oxononyl)benzoyloxy]-2-methoxy-6-(2-oxononyl)benzoate |
| Alternate Name(s) |
4-({[2-methoxy-6-(2-oxononyl)benzyl]oxy}carbonyl)phenyl 2-hydroxy-4-methoxy-6-(2-oxononyl)benzoate
Benzyl 4-[2'-hydroxy-4'-methoxy-6'-(2''-oxononyl)benzoyloxy]-2-methoxy-6-(2-oxononyl)benzoate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C41H52O9 |
| InChI |
InChI=1S/C41H52O9/c1-5-7-9-11-13-17-32(42)24-30-16-15-19-38(48-4)36(30)28-49-40(45)29-20-22-34(23-21-29)50-41(46)39-31(26-35(47-3)27-37(39)44)25-33(43)18-14-12-10-8-6-2/h15-16,19-23,26-27,44H,5-14,17-18,24-25,28H2,1-4H3 |
| InChIKey |
QJQWVKZGHAPPDB-UHFFFAOYSA-N |
| Molecular Weight |
688.858 g/mol |
| SMILES |
Oc1c(C(Oc2ccc(C(OCc3c(CC(=O)CCCCCCC)cccc3OC)=O)cc2)=O)c(cc(c1)OC)CC(=O)CCCCCCC |
| SPLASH |
splash10-03dl-0960000000-96610d00b4247088a34e |
| Source of Spectrum |
JA-49-917-0 |
| Wiley ID |
1414620 |
![benzyl 4-[2'-hydroxy-4'-methoxy-6'-(2''-oxononyl)benzoyloxy]-2-methoxy-6-(2-oxononyl)benzoate](/api/spectrum/6tyHP3H1rKw/structure.png?h=300&w=458 "benzyl 4-[2'-hydroxy-4'-methoxy-6'-(2''-oxononyl)benzoyloxy]-2-methoxy-6-(2-oxononyl)benzoate")
