| SpectraBase Spectrum ID |
1ujza1Xk5sD |
| Name |
Phenylacetic acid |
| Source of Sample |
SAFC Cat.no. W287806 |
| CAS Registry Number |
103-82-2 |
| 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 |
136.052429496 u |
| Formula |
C8H8O2 |
| InChI |
InChI=1S/C8H8O2/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H,9,10) |
| InChIKey |
WLJVXDMOQOGPHL-UHFFFAOYSA-N |
| Molecular Weight |
136.150 g/mol |
| Number of Peaks |
23 |
| RI1 |
1261 |
| RI2 |
939 |
| RI3 |
2014 |
| RI4 |
1983 |
| SMILES |
OC(Cc1ccccc1)=O |
| SPLASH |
splash10-0006-9100000000-6b0f0c37d743508ea4a4 |
| 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 |
| Wiley ID |
LM_FFNSC3_938 |
