| SpectraBase Spectrum ID |
3whoOpQi8Ui |
| Name |
BENZOIC ACID, 2-[2,4-DIMETHOXY-5-(TETRAHYDROPYRAN-2-YLOXY)PHENYL]-3,5-BISETHOXYCARBONYLMETHYLCYCLOHEXYL ESTER |
| Copyright |
Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula |
C34H44O10 |
| InChI |
InChI=1S/C13H18O4.C10H18O2.C7H6O2.C4H8O2/c1-14-10-6-7-11(12(9-10)15-2)17-13-5-3-4-8-16-13;1-2-12-10(11)8-9-6-4-3-5-7-9;8-7(9)6-4-2-1-3-5-6;1-3-6-4(2)5/h6-7,9,13H,3-5,8H2,1-2H3;9H,2-8H2,1H3;1-5H,(H,8,9);3H2,1-2H3 |
| InChIKey |
WKCKBXVHSDSUNM-UHFFFAOYSA-N |
| Molecular Weight |
618.3390 |
| SMILES |
CC(OCC)=O.C1C(CC(OCC)=O)CCCC1.c1c(OC2CCCCO2)c(OC)cc(OC)c1.OC(c1ccccc1)=O |
| SPLASH |
splash10-004i-5973150000-8ef93c08f1cc5ee8e2a5 |
| Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |
![BENZOIC ACID, 2-[2,4-DIMETHOXY-5-(TETRAHYDROPYRAN-2-YLOXY)PHENYL]-3,5-BISETHOXYCARBONYLMETHYLCYCLOHEXYL ESTER](/api/spectrum/3whoOpQi8Ui/structure.png?h=300&w=458 "BENZOIC ACID, 2-[2,4-DIMETHOXY-5-(TETRAHYDROPYRAN-2-YLOXY)PHENYL]-3,5-BISETHOXYCARBONYLMETHYLCYCLOHEXYL ESTER")
