SpectraBase Spectrum ID |
81SVFBZqCkK |
Name |
Acetamide, N-methyl-N-[4-[1-hexahydropyrazinyl]-2-butynyl]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
209.152812243 u |
Formula |
C11H19N3O |
InChI |
InChI=1S/C11H19N3O/c1-11(15)13(2)7-3-4-8-14-9-5-12-6-10-14/h12H,5-10H2,1-2H3 |
InChIKey |
PNMMGYPJEJLBGT-UHFFFAOYSA-N |
Molecular Weight |
209.293 g/mol |
SMILES |
C1N(CCNC1)CC#CCN(C(C)=O)C |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.983898 |