| SpectraBase Spectrum ID |
8JSQRCOkZB7 |
| Name |
Phenylacetate |
| Source of Sample |
SAFC Cat.no. S374121 |
| CAS Registry Number |
122-43-0 |
| Copyright |
Database Compilation Copyright © 2023-2024 John Wiley and Sons, Inc. Copyright © 2023-2024 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
192.115029753 u |
| Formula |
C12H16O2 |
| InChI |
InChI=1S/C12H16O2/c1-2-3-9-14-12(13)10-11-7-5-4-6-8-11/h4-8H,2-3,9-10H2,1H3 |
| InChIKey |
LDOXTQYWWYXYSQ-UHFFFAOYSA-N |
| Molecular Weight |
192.258 g/mol |
| Number of Peaks |
50 |
| RI1 |
1436 |
| RI2 |
1115 |
| RI3 |
1336 |
| RI4 |
1295 |
| SMILES |
c1ccc(cc1)CC(OCCCC)=O |
| SPLASH |
splash10-0006-9100000000-1cacfc40518f92f59580 |
| Sample Comments |
RI1: measured on SLB-5ms (Hydro)
RI2: measured on SLB-5ms (FAMEs)
RI3: measured on Supelcowax-10 (FAMEs)
RI4: measured on Supelcowax-10 (FAEEs)
RI5: measured on Equity-1 (Hydro) |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
Benzeneacetic acid, butyl ester |
| Wiley ID |
LM_FFNSC3_1134 |
