| SpectraBase Spectrum ID |
JnN45jGc8tO |
| Name |
Phenylacetate |
| Source of Sample |
SAFC Cat.no. W307718 |
| CAS Registry Number |
101-94-0 |
| Copyright |
Database Compilation Copyright © 2023-2025 John Wiley and Sons, Inc. Copyright © 2023-2025 John Wiley and Sons, Inc., Portions Copyright Wiley-VCH GmbH, Adams Library under license from Diablo Analytical. All Rights Reserved. |
| Exact Mass |
226.099379689 u |
| Formula |
C15H14O2 |
| InChI |
InChI=1S/C15H14O2/c1-12-7-9-14(10-8-12)17-15(16)11-13-5-3-2-4-6-13/h2-10H,11H2,1H3 |
| InChIKey |
OJEQSSJFSNLMLB-UHFFFAOYSA-N |
| Molecular Weight |
226.275 g/mol |
| Number of Peaks |
50 |
| RI1 |
1841 |
| RI2 |
1518 |
| RI3 |
2087 |
| RI4 |
2054 |
| SMILES |
C(Cc1ccccc1)(=O)Oc1ccc(cc1)C |
| SPLASH |
splash10-014l-8900000000-d8622245146c4829a3c9 |
| 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, 4-methylphenyl ester |
| Wiley ID |
LM_FFNSC3_668 |
