| SpectraBase Spectrum ID |
BJMZV5u3aH |
| Name |
2-Butyl-5-nitro-3-(6-oxocyclohex-1-en-1-yl)-1H-indole-7-carbonitrile |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C19H19N3O3 |
| InChI |
InChI=1S/C19H19N3O3/c1-2-3-7-16-18(14-6-4-5-8-17(14)23)15-10-13(22(24)25)9-12(11-20)19(15)21-16/h6,9-10,21H,2-5,7-8H2,1H3 |
| InChIKey |
LNKVBNVCKCNYDD-UHFFFAOYSA-N |
| Molecular Weight |
337.379 g/mol |
| SMILES |
[nH]1c2c(c(c1CCCC)C=1C(=O)CCCC1)cc(cc2C#N)N(=O)=O |
| SPLASH |
splash10-000l-0098000000-75faa736426c5bb6c74f |
| Source of Spectrum |
F-66-2382-6ha |
| Synonyms |
2-butyl-5-nitro-3-(6-oxo-1-cyclohexenyl)-1H-indole-7-carbonitrile
2-butyl-5-nitro-3-(6-oxocyclohexen-1-yl)-1H-indole-7-carbonitrile
2-butyl-5-nitro-3-(6-oxidanylidenecyclohexen-1-yl)-1H-indole-7-carbonitrile |
| Wiley ID |
1682319 |
