| SpectraBase Spectrum ID |
AIVwlzDH5AR |
| Name |
3-Hexanone |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
100.088815005 u |
| Formula |
C6H12O |
| InChI |
InChI=1S/C6H12O/c1-3-5-6(7)4-2/h3-5H2,1-2H3 |
| InChIKey |
PFCHFHIRKBAQGU-UHFFFAOYSA-N |
| Instrument Name |
Shimadzu GC2010 GCMS |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.202202891 |
| Molecular Weight |
100.161 g/mol |
| Quality |
332 |
| SMILES |
CCC(CCC)=O |
| SPLASH |
splash10-05fr-9100000000-84830421920272b058c0 |
| Source of Spectrum |
QE-29-SM12-Table R1-3 (DOI: 10.1002/chem.202202891) |
| Wiley ID |
1909493 |
