| SpectraBase Spectrum ID |
39T8HJUMLFj |
| Name |
Allylacetic acid |
| Source of Sample |
SAFC Cat.no. W284300 |
| CAS Registry Number |
591-80-0 |
| 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 |
100.052429496 u |
| Formula |
C5H8O2 |
| InChI |
InChI=1S/C5H8O2/c1-2-3-4-5(6)7/h2H,1,3-4H2,(H,6,7) |
| InChIKey |
HVAMZGADVCBITI-UHFFFAOYSA-N |
| Molecular Weight |
100.117 g/mol |
| Number of Peaks |
34 |
| RI1 |
933 |
| RI2 |
611 |
| SMILES |
OC(CCC=C)=O |
| SPLASH |
splash10-0pbc-9000000000-6dc030e0f0925f5d6982 |
| 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 |
4-Pentenoic acid |
| Wiley ID |
LM_FFNSC3_627 |
