| SpectraBase Spectrum ID |
997CFuwXDfc |
| Name |
Isobutyrate |
| CAS Registry Number |
547-63-7 |
| Classification |
Fatty esters; Fatty acid methyl esters |
| Copyright |
Copyright © 2016-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C5H10O2 |
| InChI |
InChI=1S/C5H10O2/c1-4(2)5(6)7-3/h4H,1-3H3 |
| InChIKey |
BHIWKHZACMWKOJ-UHFFFAOYSA-N |
| Number of Peaks |
40 |
| RI2 |
541 |
| RI4 |
789 |
| RI5 |
486 |
| SMILES |
C(C(C)C)(=O)OC |
| SPLASH |
splash10-0006-9000000000-ee2487d870c48e51e12e |
| Source of Spectrum |
Prof. L. Mondello (Chromaleont s.r.l./Univ. Messina, Italy) |
| Synonyms |
Propanoic acid, 2-methyl-, methyl ester
Me. C4:0 iso |
| Wiley ID |
LM_LIPIDS2016_144 |
