| SpectraBase Compound ID | FssNrxKtHyB |
|---|---|
| InChI | InChI=1S/C7H12N2/c8-4-3-7-9-5-1-2-6-9/h1-3,5-7H2 |
| InChIKey | PDVYZQGNSCSKPG-UHFFFAOYSA-N |
| Mol Weight | 124.19 g/mol |
| Molecular Formula | C7H12N2 |
| Exact Mass | 124.100048 g/mol |
Raman Spectrum
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| SpectraBase Spectrum ID | 8gf7nKt9iMf |
|---|---|
| Name | 1-Pyrrolidinepropionitrile |
| Comments | Computed using SmartSpectra Model v1.42 |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 124.100048394 u |
| Formula | C7H12N2 |
| InChI | InChI=1S/C7H12N2/c8-4-3-7-9-5-1-2-6-9/h1-3,5-7H2 |
| InChIKey | PDVYZQGNSCSKPG-UHFFFAOYSA-N |
| Molecular Weight | 124.187 g/mol |
| SMILES | C1CCN(C1)CCC#N |
| Spectrum/Structure Validation Score (Raman) | 0.992494 |