| SpectraBase Spectrum ID |
8I044KkbmOu |
| Name |
Acetoin |
| CAS Registry Number |
513-86-0 |
| Classification |
Flavor butter |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
88.052429496 u |
| Formula |
C4H8O2 |
| InChI |
InChI=1S/C4H8O2/c1-3(5)4(2)6/h3,5H,1-2H3 |
| InChIKey |
ROWKJAVDOGWPAT-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
88.106 g/mol |
| Nominal Mass |
88 u |
| Quality |
970 |
| Retention Index |
590 |
| SMILES |
OC(C(=O)C)C |
| SPLASH |
splash10-0005-9000000000-b7f8bbce7a18e3d2d85a |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
3-Hydroxybutan-2-one |
| Technique |
GC/MS |
| Wiley ID |
DD2024_030389 |
