| SpectraBase Spectrum ID |
Luq0KTKimWG |
| Name |
Propanedinitrile, (1H-indol-3-ylmethyl)(2-oxopropyl)- |
| Alternate Name(s) |
2-(1H-indol-3-ylmethyl)-2-(2-oxopropyl)malononitrile
4,4-Dicyano-5-(3-indolyl)pentan-2-one |
| CAS Registry Number |
121624-59-7 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H13N3O |
| InChI |
InChI=1S/C15H13N3O/c1-11(19)6-15(9-16,10-17)7-12-8-18-14-5-3-2-4-13(12)14/h2-5,8,18H,6-7H2,1H3 |
| InChIKey |
DZVIILIEYLNNAU-UHFFFAOYSA-N |
| Molecular Weight |
251.289 g/mol |
| SMILES |
[nH]1c2c(c(c1)CC(C#N)(C#N)CC(=O)C)cccc2 |
| SPLASH |
splash10-001i-0910000000-ae68ba866814f9238e4e |
| Source of Spectrum |
F-46-2950-4 |
| Wiley ID |
1254633 |
