| SpectraBase Compound ID | ITRJq5ghUts |
|---|---|
| InChI | InChI=1S/C6H7NO/c1-6(4-7)3-2-5(6)8/h2-3H2,1H3 |
| InChIKey | URDYAKCLRNWBEP-UHFFFAOYSA-N |
| Mol Weight | 109.13 g/mol |
| Molecular Formula | C6H7NO |
| Exact Mass | 109.052764 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 8X0SY0GXLdh |
|---|---|
| Name | 2-Cyano-2-methyl-1-cyclobutanone |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C6H7NO |
| InChI | InChI=1S/C6H7NO/c1-6(4-7)3-2-5(6)8/h2-3H2,1H3 |
| InChIKey | URDYAKCLRNWBEP-UHFFFAOYSA-N |
| Molecular Weight | 109.128 g/mol |
| SMILES | C1(C#N)(C(=O)CC1)C |
| SPLASH | splash10-001i-9000000000-56c3d3b5920415ab752d |
| Source of Spectrum | F-56-4286-12 |
| Synonyms | 1-methyl-2-oxocyclobutanecarbonitrile |
| Wiley ID | 857538 |