| SpectraBase Spectrum ID |
5VL2CJTh4Fs |
| Name |
6-Methyl-3-heptanone |
| CAS Registry Number |
624-42-0 |
| Classification |
Pheromone metabolite |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
128.120115134 u |
| Formula |
C8H16O |
| InChI |
InChI=1S/C8H16O/c1-4-8(9)6-5-7(2)3/h7H,4-6H2,1-3H3 |
| InChIKey |
CCCIYAQYQZQDIZ-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
128.215 g/mol |
| Nominal Mass |
128 u |
| Quality |
1000 |
| Retention Index |
881 |
| SMILES |
C(CCC(C)C)(CC)=O |
| SPLASH |
splash10-05fu-9000000000-646a6cfc03548d6b30f7 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
6-Methylheptan-3-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007536 |
