| SpectraBase Compound ID | IcoQch1j7YZ |
|---|---|
| InChI | InChI=1S/C6H7NO/c1-6-2-4-7(8)5-3-6/h2-5H,1H3 |
| InChIKey | IWYYIZOHWPCALJ-UHFFFAOYSA-N |
| Mol Weight | 109.13 g/mol |
| Molecular Formula | C6H7NO |
| Exact Mass | 109.052764 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 1GQKjUB2Omj |
|---|---|
| Name | IWYYIZOHWPCALJ-UHFFFAOYSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula | C6H7NO |
| InChI | InChI=1S/C6H7NO/c1-6-2-4-7(8)5-3-6/h2-5H,1H3 |
| InChIKey | IWYYIZOHWPCALJ-UHFFFAOYSA-N |
| Literature Reference Author | ORGANIC_CHEMISTRY_(NMR-DEPARTMENT);UNIVERSITY_MAINZ |
| Literature Reference Citation | UNI_MAINZ,INTERNAL_DB(2007) |
| Molecular Weight | 109.128 g/mol |
| Source File Reference | MHKO16185 |