| SpectraBase Spectrum ID |
EQ6lkwZqPbr |
| Name |
2-Acetonyl-3-cyano-2,3-dimethylcyclobutane-1-carboxylic acid |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C11H15NO3 |
| InChI |
InChI=1S/C11H15NO3/c1-7(13)4-11(3)8(9(14)15)5-10(11,2)6-12/h8H,4-5H2,1-3H3,(H,14,15) |
| InChIKey |
JBCUYBXJXHTVKB-UHFFFAOYSA-N |
| Molecular Weight |
209.245 g/mol |
| SMILES |
OC(C1C(C(C#N)(C)C1)(CC(=O)C)C)=O |
| SPLASH |
splash10-0006-9000000000-1ec2260fd0510d20fb86 |
| Source of Spectrum |
Y-30-422-7 |
| Synonyms |
(1S,2S)-2-Acetyl-3-cyano-2,3-dimethyl-cyclobutanecarboxylic acid
3-cyano-2,3-dimethyl-2-(2-oxopropyl)cyclobutanecarboxylic acid |
| Wiley ID |
1208131 |
