| SpectraBase Spectrum ID |
EqnG5V3rvgf |
| Name |
Marmesin - caprylate |
| Alternate Name(s) |
7-[1'-Methyl-1'-(octanoyloxy)ethyl]-furo[2,3-7',8']benzopyran-2(2H)-one |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28O5 |
| InChI |
InChI=1S/C22H28O5/c1-4-5-6-7-8-9-21(24)27-22(2,3)19-13-16-12-15-10-11-20(23)26-17(15)14-18(16)25-19/h10-12,14,19H,4-9,13H2,1-3H3 |
| InChIKey |
BADIENIPRCEEJX-UHFFFAOYSA-N |
| Molecular Weight |
372.461 g/mol |
| SMILES |
c12OC(Cc2cc2c(c1)OC(=O)C=C2)C(OC(=O)CCCCCCC)(C)C |
| SPLASH |
splash10-03fr-1090000000-856af0d34960a1d890f5 |
| Source of Spectrum |
X4-12-587-0 |
| Wiley ID |
1585099 |
