| SpectraBase Spectrum ID |
9QSR1PT2Exl |
| Name |
Benzoic acid, 2,4-dimethoxy-6-pentyl-, 4-carboxy-3-hydroxy-5-pentylphenyl ester |
| CAS Registry Number |
38968-06-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C26H34O7 |
| InChI |
InChI=1S/C26H34O7/c1-5-7-9-11-17-14-20(15-21(27)23(17)25(28)29)33-26(30)24-18(12-10-8-6-2)13-19(31-3)16-22(24)32-4/h13-16,27H,5-12H2,1-4H3,(H,28,29) |
| InChIKey |
FPUYCHGCPUBJFV-UHFFFAOYSA-N |
| Molecular Weight |
458.551 g/mol |
| SMILES |
Oc1cc(cc(c1C(=O)O)CCCCC)OC(c1c(cc(cc1CCCCC)OC)OC)=O |
| SPLASH |
splash10-0udj-0940000000-183a283809ed70a62a0a |
| Source of Spectrum |
B-27-1777-5 |
| Synonyms |
2-O-methylperlatolic acid
4-[(2,4-dimethoxy-6-pentylbenzoyl)oxy]-2-hydroxy-6-pentylbenzoic acid |
| Wiley ID |
1389903 |
