| SpectraBase Spectrum ID |
GQQ0zCpz46y |
| Name |
Benzoic acid, 2-heptyl-6-hydroxy-4-[[2-methyl-4,6-bis(phenylmethoxy)benzoyl]oxy]-, phenylmethyl ester |
| CAS Registry Number |
111699-59-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C43H44O7 |
| InChI |
InChI=1S/C43H44O7/c1-3-4-5-6-16-23-35-25-37(26-38(44)41(35)42(45)49-30-34-21-14-9-15-22-34)50-43(46)40-31(2)24-36(47-28-32-17-10-7-11-18-32)27-39(40)48-29-33-19-12-8-13-20-33/h7-15,17-22,24-27,44H,3-6,16,23,28-30H2,1-2H3 |
| InChIKey |
FWGOQZBYTUJRSU-UHFFFAOYSA-N |
| Molecular Weight |
672.818 g/mol |
| SMILES |
Oc1cc(OC(c2c(cc(cc2C)OCc2ccccc2)OCc2ccccc2)=O)cc(c1C(OCc1ccccc1)=O)CCCCCCC |
| SPLASH |
splash10-0006-9000000000-803d27b6545391bb0d25 |
| Source of Spectrum |
B-40-428-14 |
| Synonyms |
4-[(benzyloxy)carbonyl]-3-heptyl-5-hydroxyphenyl 2,4-bis(benzyloxy)-6-methylbenzoate
Benzyl 2,4-di-O-benzyl-4-O-demethylsphaerophorinate |
| Wiley ID |
1414029 |
![Benzoic acid, 2-heptyl-6-hydroxy-4-[[2-methyl-4,6-bis(phenylmethoxy)benzoyl]oxy]-, phenylmethyl ester](/api/spectrum/GQQ0zCpz46y/structure.png?h=300&w=458 "Benzoic acid, 2-heptyl-6-hydroxy-4-[[2-methyl-4,6-bis(phenylmethoxy)benzoyl]oxy]-, phenylmethyl ester")
