| SpectraBase Spectrum ID |
IeT8izhHxHs |
| Name |
Benzoic acid, 2-hydroxy-3-[(4-hydroxy-2-methoxy-6-propylbenzoyl)oxy]-4-methoxy-6-propyl- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
418.162767789 u |
| Formula |
C22H26O8 |
| InChI |
InChI=1S/C22H26O8/c1-5-7-12-9-14(23)11-15(28-3)17(12)22(27)30-20-16(29-4)10-13(8-6-2)18(19(20)24)21(25)26/h9-11,23-24H,5-8H2,1-4H3,(H,25,26) |
| InChIKey |
PMTPDCTYVRVNCB-UHFFFAOYSA-N |
| Molecular Weight |
418.442 g/mol |
| SMILES |
C(OC1=C(OC)C=C(C(=C1O)C(O)=O)CCC)(=O)C1=C(CCC)C=C(C=C1OC)O |
![Benzoic acid, 2-hydroxy-3-[(4-hydroxy-2-methoxy-6-propylbenzoyl)oxy]-4-methoxy-6-propyl-](/api/spectrum/IeT8izhHxHs/structure.png?h=300&w=458 "Benzoic acid, 2-hydroxy-3-[(4-hydroxy-2-methoxy-6-propylbenzoyl)oxy]-4-methoxy-6-propyl-")
