| SpectraBase Spectrum ID |
2l3N9UDTMyu |
| Name |
Butanoic acid |
| CAS Registry Number |
107-92-6 |
| Classification |
Fatty acid |
| Comments |
Spectrum verified by independent measurements in external laboratories |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
88.052429496 u |
| Formula |
C4H8O2 |
| InChI |
InChI=1S/C4H8O2/c1-2-3-4(5)6/h2-3H2,1H3,(H,5,6) |
| InChIKey |
FERIUCNNQQJTOY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
88.106 g/mol |
| Nominal Mass |
88 u |
| Quality |
938 |
| Retention Index |
590 |
| SMILES |
OC(CCC)=O |
| SPLASH |
splash10-03dl-9000000000-04eaa9fdca732c9353ec |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Butyric acid
n-Butanoic acid |
| Technique |
GC/MS |
| Wiley ID |
DD2024_011607 |
