| SpectraBase Spectrum ID |
JEa484B1m0O |
| Name |
2,5-Dimethyl-1H-pyrrole-3-carbonitrile |
| Classification |
Chemical |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
120.068748266 u |
| Formula |
C7H8N2 |
| InChI |
InChI=1S/C7H8N2/c1-5-3-7(4-8)6(2)9-5/h3,9H,1-2H3 |
| InChIKey |
BZSMKTGDBPDVAR-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
120.155 g/mol |
| Nominal Mass |
120 u |
| Quality |
991 |
| Retention Index |
976 |
| SMILES |
C1(=C(C=C(N1)C)C#N)C |
| SPLASH |
splash10-014i-9800000000-f2b945e1b32c9f0d1932 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2,5-dimethyl-1H-pyrrole-3-carbonitrile |
| Technique |
GC/MS |
| Wiley ID |
DD2024_035093 |
