| SpectraBase Compound ID | 7W90wocX76t |
|---|---|
| InChI | InChI=1S/C5H7NO/c1-5(7)3-2-4-6/h2-3H2,1H3 |
| InChIKey | JFVBCXHSPKJLRP-UHFFFAOYSA-N |
| Mol Weight | 97.12 g/mol |
| Molecular Formula | C5H7NO |
| Exact Mass | 97.052764 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 9WXvm2anzz6 |
|---|---|
| Name | 4-OXOVALERONITRILE |
| Source of Sample | R. Rupprecht, W. Bremser BASF Ludwigshafen (1978) |
| CAS Registry Number | 927-56-0 |
| Copyright | Copyright © 1980, 1981-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C5H7NO |
| InChI | InChI=1S/C5H7NO/c1-5(7)3-2-4-6/h2-3H2,1H3 |
| InChIKey | JFVBCXHSPKJLRP-UHFFFAOYSA-N |
| Molecular Weight | 97.18 |
| Solvent | Chloroform-d; Reference=TMS; Temperature=Ambient Spectrometer= Bruker WP-80 |
| Synonyms | VALERONITRILE, 4-OXO-, |