| SpectraBase Spectrum ID |
5bURRzitOir |
| Name |
1,3,4,5-TETRAHYDROXYCYCLOHEXANECARBOXYLIC ACID, 3-(3,4-DIHYDROXYCINNAMATE) CHLORGENIC ACID |
| Source of Sample |
Aldrich Chemical Company, Inc., Milwaukee, Wisconsin |
| Comments |
Tentative assignment |
| Copyright |
Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H18O9 |
| InChI |
InChI=1S/C16H18O9/c17-9-3-1-8(5-10(9)18)2-4-13(20)25-12-7-16(24,15(22)23)6-11(19)14(12)21/h1-5,11-12,14,17-19,21,24H,6-7H2,(H,22,23)/b4-2+/t11-,12-,14-,16+/m1/s1 |
| InChIKey |
CWVRJTMFETXNAD-JUHZACGLSA-N |
| Melting Point |
207-209C |
| Molecular Weight |
354.32 |
| Solvent |
Polysol; Reference=TMS Spectrometer= Varian CFT-20 |
| Synonyms |
QUINIC ACID, 5-CAFFEOYL-,
CINNAMIC ACID, 3,4-DIHYDROXY-, 5-CARBOXY-2,3,5-TRIHYDROXYCYCLOHEXYL ESTER
CHLOROGENIC ACID |
