| SpectraBase Compound ID | A61DSG6W1Vb |
|---|---|
| InChI | InChI=1S/C17H13N3/c1-10-13-8-14-12-4-2-3-5-16(12)20-17(14)15(9-18)11(13)6-7-19-10/h2-5,8,20H,6-7H2,1H3 |
| InChIKey | ITCXGUMIXASFCW-UHFFFAOYSA-N |
| Mol Weight | 259.31 g/mol |
| Molecular Formula | C17H13N3 |
| Exact Mass | 259.110947 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 7mpuN5B6LBm |
|---|---|
| Name | 5-Cyano-3,4-dihydroolivacine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C17H13N3 |
| InChI | InChI=1S/C17H13N3/c1-10-13-8-14-12-4-2-3-5-16(12)20-17(14)15(9-18)11(13)6-7-19-10/h2-5,8,20H,6-7H2,1H3 |
| InChIKey | ITCXGUMIXASFCW-UHFFFAOYSA-N |
| Molecular Weight | 259.312 g/mol |
| SMILES | [nH]1c2ccccc2c2c1c(c1c(c2)C(=NCC1)C)C#N |
| SPLASH | splash10-0a4i-0090000000-58420efef157ee303f16 |
| Source of Spectrum | SO-0-601-36 |
| Wiley ID | 1545711 |