| SpectraBase Spectrum ID |
BStrvANC1r7 |
| Name |
2-Methylbutanoic acid |
| CAS Registry Number |
116-53-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C5H10O2 |
| GC Column |
J&W DB-5 (30 m x 0.25 mm ID x 0.25 ??m film thickness) |
| GC Oven Program |
60 ??C to 246 ??C at 3 ??C/min. |
| InChI |
InChI=1S/C5H10O2/c1-3-4(2)5(6)7/h4H,3H2,1-2H3,(H,6,7) |
| InChIKey |
WLAMNBDJUVNPJU-UHFFFAOYSA-N |
| Molecular Weight |
102.133 g/mol |
| SMILES |
OC(C(CC)C)=O |
| SPLASH |
splash10-00di-9000000000-e52c127f6f3ff164f340 |
| Source |
ex BEDOUKIAN ex JJ BROPHY |
| Source of Spectrum |
Adams' Essential Oil Components (GC-MS), Version 4 |
| Synonyms |
Butanoic acid<2-methyl-> |
| Wiley ID |
1887214 |
