| SpectraBase Spectrum ID |
5zcbjnZCzCz |
| Name |
Pentan-3-one |
| Source of Sample |
SAFC Cat.no. W510106 |
| CAS Registry Number |
96-22-0 |
| 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 |
86.073164941 u |
| Formula |
C5H10O |
| InChI |
InChI=1S/C5H10O/c1-3-5(6)4-2/h3-4H2,1-2H3 |
| InChIKey |
FDPIMTJIUBPUKL-UHFFFAOYSA-N |
| Molecular Weight |
86.134 g/mol |
| Number of Peaks |
37 |
| RI1 |
697 |
| RI3 |
388 |
| RI4 |
361 |
| SMILES |
CCC(CC)=O |
| SPLASH |
splash10-0a4i-9000000000-abdacc031d3ece5ad26d |
| 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 |
3-Pentanone |
| Wiley ID |
LM_FFNSC3_708 |
