SpectraBase Spectrum ID |
1ovfWvWnmR6 |
Name |
Piperidine, 1-(2,3-dihydrobenzo[B]thien-2-yl)- |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
219.108170725 u |
Formula |
C13H17NS |
InChI |
InChI=1S/C13H17NS/c1-4-8-14(9-5-1)13-10-11-6-2-3-7-12(11)15-13/h2-3,6-7,13H,1,4-5,8-10H2 |
InChIKey |
MEIZLMKRFAUFNE-UHFFFAOYSA-N |
Molecular Weight |
219.346 g/mol |
SMILES |
C1(SC2=CC=CC=C2C1)N1CCCCC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.832014 |