| SpectraBase Spectrum ID |
8URWHiGYts7 |
| Name |
2'-(1-Acetoxymethyl-1-cyclohexen-3-yl)-5'-(1,1-dimethylheptyl)resorcinol diacetate |
| Alternate Name(s) |
3-(acetyloxy)-2-{3-[(acetyloxy)methyl]-2-cyclohexen-1-yl}-5-(1,1-dimethylheptyl)phenyl acetate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C28H40O6 |
| InChI |
InChI=1S/C28H40O6/c1-7-8-9-10-14-28(5,6)24-16-25(33-20(3)30)27(26(17-24)34-21(4)31)23-13-11-12-22(15-23)18-32-19(2)29/h15-17,23H,7-14,18H2,1-6H3 |
| InChIKey |
QQSHJTOJVSIBMM-UHFFFAOYSA-N |
| Molecular Weight |
472.622 g/mol |
| SMILES |
c1(c(cc(cc1OC(=O)C)C(CCCCCC)(C)C)OC(=O)C)C1C=C(COC(=O)C)CCC1 |
| SPLASH |
splash10-03k9-0006900000-44c7804793964e3c1397 |
| Source of Spectrum |
QB-14-508-6 |
| Wiley ID |
841314 |
