| SpectraBase Spectrum ID |
LnRdOUcczBP |
| Name |
Propanedinitrile, [2,2-dimethyl-1-(3-nitrophenyl)propyl]ethyl- |
| Alternate Name(s) |
2-[2,2-dimethyl-1-(3-nitrophenyl)propyl]-2-ethylmalononitrile
Isomer of 2-[2,2-dimethyl-1-(m-nitrophenyl)propyl]-2-ethylmalononitrile |
| CAS Registry Number |
86096-94-8 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H19N3O2 |
| InChI |
InChI=1S/C16H19N3O2/c1-5-16(10-17,11-18)14(15(2,3)4)12-7-6-8-13(9-12)19(20)21/h6-9,14H,5H2,1-4H3 |
| InChIKey |
FRKWIHBPVDTDSD-UHFFFAOYSA-N |
| Molecular Weight |
285.347 g/mol |
| SMILES |
c1(N(=O)=O)cc(C(C(C#N)(C#N)CC)C(C)(C)C)ccc1 |
| SPLASH |
splash10-0a4i-9100000000-75d6b29b7d468a3f2e23 |
| Source of Spectrum |
B-36-94-0 |
| Wiley ID |
1288955 |
![Propanedinitrile, [2,2-dimethyl-1-(3-nitrophenyl)propyl]ethyl-](/api/spectrum/LnRdOUcczBP/structure.png?h=300&w=458 "Propanedinitrile, [2,2-dimethyl-1-(3-nitrophenyl)propyl]ethyl-")
