| SpectraBase Spectrum ID |
4rnE8FDJeFf |
| Name |
Caffeic Acid Phenylethyl Ester |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
70750 |
| Lot Number |
0617327-17 |
| Accessory |
DurasamplIR II |
| CAS Registry Number |
104594-70-9 |
| Copyright |
Copyright © 2019-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
284.104858991 u |
| Formula |
C17H16O4 |
| InChI |
InChI=1S/C17H16O4/c18-15-8-6-14(12-16(15)19)7-9-17(20)21-11-10-13-4-2-1-3-5-13/h1-9,12,18-19H,10-11H2/b9-7+ |
| InChIKey |
SWUARLUWKZWEBQ-VQHVLOKHSA-N |
| Instrument Name |
Bio-Rad FTS |
| Molecular Weight |
284.311 g/mol |
| Purity |
≥98% |
| Resolution |
4 |
| SMILES |
OC=1C=C(C=CC1O)\C=C\C(=O)OCCC1=CC=CC=C1 |
| Scan Speed (number) |
5 |
| Source of Spectrum |
Forensic Spectral Research |
| Synonyms |
(E)-3-(3,4-dihydroxyphenyl)-2-propenoic acid, 2-phenylethyl ester
2-Phenylethyl Caffeate
CAPE
β-Phenylethyl Caffeate |
| Technique |
ATR-Neat |
