| SpectraBase Spectrum ID |
6dnZTQsDkdn |
| Name |
2-(N-Ethylacetamido)-3-[4-(2-cyanoethyl)piperazino]-1,4-naphthoquinone |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
380.184840646 u |
| Formula |
C21H24N4O3 |
| InChI |
InChI=1S/C21H24N4O3/c1-3-25(15(2)26)19-18(24-13-11-23(12-14-24)10-6-9-22)20(27)16-7-4-5-8-17(16)21(19)28/h4-5,7-8H,3,6,10-14H2,1-2H3 |
| InChIKey |
GWSFOMDQGROUFH-UHFFFAOYSA-N |
| Molecular Weight |
380.448 g/mol |
| SMILES |
C1(=C(C(=O)C=2C(C1=O)=CC=CC2)N(C(=O)C)CC)N1CCN(CCC#N)CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.966315 |
![2-(n-Ethylacetamido)-3-[4-(2-cyanoethyl)piperazino]-1,4-naphthoquinone](/api/spectrum/6dnZTQsDkdn/structure.png?h=300&w=458 "2-(n-Ethylacetamido)-3-[4-(2-cyanoethyl)piperazino]-1,4-naphthoquinone")
