| SpectraBase Spectrum ID |
7IuYVkc1tX4 |
| Name |
Ethyl benzoylacetate |
| CAS Registry Number |
94-02-0 |
| 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 |
192.078644243 u |
| Formula |
C11H12O3 |
| InChI |
InChI=1S/C11H12O3/c1-2-14-11(13)8-10(12)9-6-4-3-5-7-9/h3-7H,2,8H2,1H3 |
| InChIKey |
GKKZMYDNDDMXSE-UHFFFAOYSA-N |
| Molecular Weight |
192.214 g/mol |
| Number of Peaks |
50 |
| RI1 |
1515 |
| RI2 |
1191 |
| RI3 |
410 |
| RI4 |
380 |
| SMILES |
C(=O)(CC(OCC)=O)c1ccccc1 |
| SPLASH |
splash10-0a4i-5900000000-6fda5f4c95755eb65a31 |
| 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 |
Benzenepropanoic acid, b-oxo-, ethyl ester |
| Wiley ID |
LM_FFNSC3_1871 |
