SpectraBase Compound ID | CVy7LvzZAwK |
---|---|
InChI | InChI=1S/C5H6N2/c6-2-1-3-7-4-5-7/h1,3H,4-5H2/b3-1+ |
InChIKey | RJCJARUNJZKFNX-HNQUOIGGSA-N |
Mol Weight | 94.12 g/mol |
Molecular Formula | C5H6N2 |
Exact Mass | 94.053098 g/mol |
SpectraBase Spectrum ID | 4woschBNkZC |
---|---|
Name | N-Acrylonitrylaziridine |
Comments | Computed using SmartSpectra Model v1.42 |
Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass | 94.053098201 u |
Formula | C5H6N2 |
InChI | InChI=1S/C5H6N2/c6-2-1-3-7-4-5-7/h1,3H,4-5H2/b3-1+ |
InChIKey | RJCJARUNJZKFNX-HNQUOIGGSA-N |
Molecular Weight | 94.117 g/mol |
SMILES | C1N(C1)\C=C\C#N |
Spectrum/Structure Validation Score (Vapor Phase IR) | 0.847991 |