| SpectraBase Spectrum ID |
JFq9XM841dg |
| Name |
6-Undecanone |
| CAS Registry Number |
927-49-1 |
| Classification |
Flavor |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
170.167065327 u |
| Formula |
C11H22O |
| InChI |
InChI=1S/C11H22O/c1-3-5-7-9-11(12)10-8-6-4-2/h3-10H2,1-2H3 |
| InChIKey |
ZPQAKYPOZRXKFA-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
170.296 g/mol |
| Nominal Mass |
170 u |
| Quality |
925 |
| Retention Index |
1181 |
| SMILES |
C(CCCCC)(CCCCC)=O |
| SPLASH |
splash10-0abd-9000000000-6a8b32e2c7fd37b82787 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Amyl ketone
Diamyl ketone
Dipentyl ketone
Undecan-6-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_008122 |
