| SpectraBase Spectrum ID |
Fy5c9EI2BnW |
| Name |
Phenylacetate |
| Source of Sample |
SAFC Cat.no. W295604 |
| CAS Registry Number |
4861-85-2 |
| 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 |
178.099379689 u |
| Formula |
C11H14O2 |
| InChI |
InChI=1S/C11H14O2/c1-9(2)13-11(12)8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3 |
| InChIKey |
SSMBXPJYHMZLOJ-UHFFFAOYSA-N |
| Molecular Weight |
178.231 g/mol |
| Number of Peaks |
50 |
| RI1 |
1273 |
| RI2 |
951 |
| RI3 |
1158 |
| RI4 |
1118 |
| RI5 |
1250 |
| SMILES |
C(Cc1ccccc1)(=O)OC(C)C |
| SPLASH |
splash10-0006-9000000000-acb002dc113d937d9af9 |
| 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, 1-methylethyl ester |
| Wiley ID |
LM_FFNSC3_688 |
