SpectraBase Spectrum ID |
L5sRKvsaYeu |
Name |
1-(Piperdin-1-yl)-3-(pyrrolidin-1-yl)butan-1-thione |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
240.166019955 u |
Formula |
C13H24N2S |
InChI |
InChI=1S/C13H24N2S/c1-12(14-7-5-6-8-14)11-13(16)15-9-3-2-4-10-15/h12H,2-11H2,1H3 |
InChIKey |
BPSLYDPRZDPECG-UHFFFAOYSA-N |
Molecular Weight |
240.409 g/mol |
SMILES |
C(CC(N1CCCC1)C)(N1CCCCC1)=S |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.960873 |