| SpectraBase Compound ID | JYSotLQJhg6 |
|---|---|
| InChI | InChI=1S/C9H13NO/c1-2-3-4-7-10-8-5-6-9(10)11/h2-4,7H,5-6,8H2,1H3/b3-2+,7-4+ |
| InChIKey | IEYZCARKWGHPHC-AOGGBPEJSA-N |
| Mol Weight | 151.21 g/mol |
| Molecular Formula | C9H13NO |
| Exact Mass | 151.099714 g/mol |
| SpectraBase Spectrum ID | 6arCiW8tY4I |
|---|---|
| Name | N-1,3-Pentadienyl-2-pyrrolidinone |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 151.099714042 u |
| Formula | C9H13NO |
| InChI | InChI=1S/C9H13NO/c1-2-3-4-7-10-8-5-6-9(10)11/h2-4,7H,5-6,8H2,1H3/b3-2+,7-4+ |
| InChIKey | IEYZCARKWGHPHC-AOGGBPEJSA-N |
| Molecular Weight | 151.209 g/mol |
| SMILES | C1(N(CCC1)\C=C\C=C\C)=O |
| Spectrum/Structure Validation Score (Vapor Phase IR) | 0.974787 |