| SpectraBase Spectrum ID |
BUfbRy7UFVB |
| Name |
Butanoic acid, 3,3-dimethyl- |
| CAS Registry Number |
1070-83-3 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C6H12O2 |
| InChI |
InChI=1S/C6H12O2/c1-6(2,3)4-5(7)8/h4H2,1-3H3,(H,7,8) |
| InChIKey |
MLMQPDHYNJCQAO-UHFFFAOYSA-N |
| Molecular Weight |
116.160 g/mol |
| SMILES |
OC(CC(C)(C)C)=O |
| SPLASH |
splash10-0a4i-9200000000-357cf356599c1de7de2c |
| Source of Spectrum |
J-53-2014-0 |
| Synonyms |
Butyric acid, 3,3-dimethyl-
(CH3)3CCH2COOH
3,3-Dimethyl-butyric acid
3,3-Dimethyl-n-butyric acid
3,3-Dimethylbutanoic acid
t-Butylacetic acid
tert-Butylacetic acid
AI3-19252
EINECS 213-982-2
NSC 4537 |
| Wiley ID |
1125462 |
