| SpectraBase Compound ID | WimEzGgBPt |
|---|---|
| InChI | InChI=1S/C6H5N3/c7-3-1-2-6(4-8)5-9/h1-2,4H,8H2/b2-1+,6-4+ |
| InChIKey | LOVNPCBVZRJWNA-ZMVSMXTFSA-N |
| Mol Weight | 119.13 g/mol |
| Molecular Formula | C6H5N3 |
| Exact Mass | 119.048347 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 9pbz87lRV4B |
|---|---|
| Name | GLUTACONONITRILE, 4-(AMINOMETHYLENE)- |
| Copyright | Copyright © 2002-2024 Wiley-VCH Verlag GmbH & Co. KGaA. All Rights Reserved. |
| Formula | C6H5N3 |
| InChI | InChI=1S/C6H5N3/c7-3-1-2-6(4-8)5-9/h1-2,4H,8H2/b2-1+,6-4+ |
| InChIKey | LOVNPCBVZRJWNA-ZMVSMXTFSA-N |
| Molecular Weight | 119.0483 |
| SMILES | N\C=C/(\C=C\C#N)C#N |
| SPLASH | splash10-00kf-9200000000-df046c53640a1b1fe155 |
| Source of Spectrum | Chemical Concepts, A Wiley Division, Weinheim, Germany |