| SpectraBase Spectrum ID |
Hycku5XAXxy |
| Name |
Phenethyl caffeiate |
| Source of Sample |
Cayman Chemical Company |
| Catalog Number |
70750 |
| Lot Number |
0463793-14 |
| Acronyms |
CAPE |
| CAS Registry Number |
104594-70-9 |
| Cell Type |
NMR tube |
| Compound Type |
Pure |
| Copyright |
Copyright © 2015-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H16O4 |
| IUPAC Name |
(E)-3-(3,4-Dihydroxyphenyl)-2-propenoic acid, 2-phenylethyl ester |
| 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 |
| Raman Corrections |
Referenced to internal white light source; 180 degree backscatter |
| Raman Laser Power |
502 mW |
| Raman Laser Source |
Nd:YAG |
| SMILES |
Oc1c(ccc(c1)\C=C\C(OCCc1ccccc1)=O)O |
| Scans Performed |
3136 |
| Source of Spectrum |
Forensic Spectral Research |
| Synonyms |
2-Phenylethyl caffeate; β-Phenylethyl caffeate |
| Technique |
FT-Raman |
