![4-[(1'-Mwethylindol-3'-yl)methylidene]pent-2-enedinitrile](/api/spectrum/7lk6LZipIAv/structure.png?h=300&w=458 "4-[(1'-Mwethylindol-3'-yl)methylidene]pent-2-enedinitrile")
| SpectraBase Compound ID | 91KwE7ajIqs |
|---|---|
| InChI | InChI=1S/C15H11N3/c1-18-11-13(9-12(10-17)5-4-8-16)14-6-2-3-7-15(14)18/h2-7,9,11H,1H3/b5-4+,12-9- |
| InChIKey | DJFZORYLXLTPLM-RBCGRJENSA-N |
| Mol Weight | 233.27 g/mol |
| Molecular Formula | C15H11N3 |
| Exact Mass | 233.095297 g/mol |
13C Nuclear Magnetic Resonance (NMR) Chemical Shifts
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| SpectraBase Spectrum ID | 7lk6LZipIAv |
|---|---|
| Name | 4-[(1'-Mwethylindol-3'-yl)methylidene]pent-2-enedinitrile |
| Comments | Computed using HOSE algorithm |
| Copyright | Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass | 233.095297366 u |
| Formula | C15H11N3 |
| InChI | InChI=1S/C15H11N3/c1-18-11-13(9-12(10-17)5-4-8-16)14-6-2-3-7-15(14)18/h2-7,9,11H,1H3/b5-4+,12-9- |
| InChIKey | DJFZORYLXLTPLM-RBCGRJENSA-N |
| Molecular Weight | 233.274 g/mol |
| SMILES | C1(=CN(C)C2=C1C=CC=C2)\C=C/(C#N)\C=C\C#N |