| SpectraBase Spectrum ID |
ExpkThw6ITT |
| Name |
Benzoic acid, 2-hydroxy-4-methoxy-6-[(2-propyl-1,3-dioxolan-2-yl)methyl]-, phenylmethyl ester |
| Alternate Name(s) |
Benzyl 2-hydroxy-4-methoxy-6-[(2-propyl-1,3-dioxolan-2-yl)methyl]benzoate |
| CAS Registry Number |
127743-32-2 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H26O6 |
| InChI |
InChI=1S/C22H26O6/c1-3-9-22(27-10-11-28-22)14-17-12-18(25-2)13-19(23)20(17)21(24)26-15-16-7-5-4-6-8-16/h4-8,12-13,23H,3,9-11,14-15H2,1-2H3 |
| InChIKey |
IYSYYSYPMNYFAD-UHFFFAOYSA-N |
| Molecular Weight |
386.444 g/mol |
| SMILES |
Oc1c(c(CC2(OCCO2)CCC)cc(c1)OC)C(OCc1ccccc1)=O |
| SPLASH |
splash10-014i-0900000000-f6e00d183baa2c589cc1 |
| Source of Spectrum |
B-42-1976-21 |
| Wiley ID |
1362712 |
![Benzoic acid, 2-hydroxy-4-methoxy-6-[(2-propyl-1,3-dioxolan-2-yl)methyl]-, phenylmethyl ester](/api/spectrum/ExpkThw6ITT/structure.png?h=300&w=458 "Benzoic acid, 2-hydroxy-4-methoxy-6-[(2-propyl-1,3-dioxolan-2-yl)methyl]-, phenylmethyl ester")
