| SpectraBase Spectrum ID |
IOptL3h3DAu |
| Name |
Allyl acetylacetate |
| Source of Sample |
Penta Manifacturing Prod. code 01-16000 |
| CAS Registry Number |
1118-84-9 |
| 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 |
142.062994179 u |
| Formula |
C7H10O3 |
| InChI |
InChI=1S/C7H10O3/c1-3-4-10-7(9)5-6(2)8/h3H,1,4-5H2,2H3 |
| InChIKey |
AXLMPTNTPOWPLT-UHFFFAOYSA-N |
| Molecular Weight |
142.154 g/mol |
| Number of Peaks |
50 |
| RI1 |
1020 |
| RI2 |
692 |
| RI3 |
1011 |
| RI4 |
967 |
| SMILES |
C(C)(=O)CC(=O)OCC=C |
| SPLASH |
splash10-0006-9000000000-2a1e563545a0a5e8b654 |
| 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 |
Butanoic acid, 3-oxo-, 2-propen-1-yl ester |
| Wiley ID |
LM_FFNSC3_2980 |
