| SpectraBase Spectrum ID |
4i8EjlJnTEA |
| Name |
6-Aminohexanamide, N-methyl-N-[4-(1-pyrrolidinyl)-2-butynyl]-N'-[2-aminobutanoyl]- |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
336.252526284 u |
| Formula |
C18H32N4O2 |
| InChI |
InChI=1S/C18H32N4O2/c1-21(13-5-6-14-22-15-7-8-16-22)18(24)9-3-2-4-12-20-17(23)10-11-19/h2-4,7-16,19H2,1H3,(H,20,23) |
| InChIKey |
JHRXLGQHHFTYKL-UHFFFAOYSA-N |
| Molecular Weight |
336.480 g/mol |
| SMILES |
C1CN(CC#CCN(C(=O)CCCCCNC(CCN)=O)C)CC1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.818325 |
![6-Aminohexanamide, N-methyl-N-[4-(1-pyrrolidinyl)-2-butynyl]-N'-[2-aminobutanoyl]-](/api/spectrum/4i8EjlJnTEA/structure.png?h=300&w=458 "6-Aminohexanamide, N-methyl-N-[4-(1-pyrrolidinyl)-2-butynyl]-N'-[2-aminobutanoyl]-")
