| SpectraBase Spectrum ID |
E2EHhFDypyT |
| Name |
Propionate |
| Source of Sample |
SAFC Cat.no. W243507 |
| CAS Registry Number |
10031-90-0 |
| 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 |
168.078644243 u |
| Formula |
C9H12O3 |
| InChI |
InChI=1S/C9H12O3/c1-2-11-9(10)6-5-8-4-3-7-12-8/h3-4,7H,2,5-6H2,1H3 |
| InChIKey |
OWIWZQQFSTZZIG-UHFFFAOYSA-N |
| Molecular Weight |
168.192 g/mol |
| Number of Peaks |
50 |
| RI1 |
1181 |
| RI2 |
859 |
| RI3 |
1081 |
| RI4 |
1037 |
| SMILES |
C(CCc1occc1)(=O)OCC |
| SPLASH |
splash10-000x-9100000000-52ed6c4882b1af075907 |
| 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 |
2-Furanpropanoic acid, ethyl ester |
| Wiley ID |
LM_FFNSC3_335 |
