SpectraBase Spectrum ID |
6yogPAc1mVT |
Name |
8-(Acetamido)octamide, N-methyl-N-[4-(1-pyrrolidinyl)-2-butynyl]- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
335.257277313 u |
Formula |
C19H33N3O2 |
InChI |
InChI=1S/C19H33N3O2/c1-18(23)20-13-7-5-3-4-6-12-19(24)21(2)14-8-9-15-22-16-10-11-17-22/h3-7,10-17H2,1-2H3,(H,20,23) |
InChIKey |
VZNMIKAJDBRNBA-UHFFFAOYSA-N |
Molecular Weight |
335.492 g/mol |
SMILES |
C1N(CCC1)CC#CCN(C)C(CCCCCCCNC(C)=O)=O |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.841895 |