| SpectraBase Spectrum ID |
5ZfOvCkj5JQ |
| Name |
Isoamylformiate |
| CAS Registry Number |
110-45-2 |
| Classification |
Flavor, fragrance |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
116.083729624 u |
| Formula |
C6H12O2 |
| InChI |
InChI=1S/C6H12O2/c1-6(2)3-4-8-5-7/h5-6H,3-4H2,1-2H3 |
| InChIKey |
XKYICAQFSCFURC-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
116.160 g/mol |
| Nominal Mass |
116 u |
| Quality |
987 |
| Retention Index |
828 |
| SMILES |
C(OCCC(C)C)=O |
| SPLASH |
splash10-006x-9000000000-2195c4d1cb6f4c6d0fc4 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Isopentyl formate
3-Methylbutyl formate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_006991 |
