| SpectraBase Spectrum ID |
DALptBBXTvg |
| Name |
4-[(1,4-Dihydronaphth-1-yl)thio]-1,4-dihydroquinoline |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
291.108170725 u |
| Formula |
C19H17NS |
| InChI |
InChI=1S/C19H17NS/c1-2-8-15-14(6-1)7-5-11-18(15)21-19-12-13-20-17-10-4-3-9-16(17)19/h1-6,8-13,18-20H,7H2 |
| InChIKey |
SMLSIBJESRJSTM-UHFFFAOYSA-N |
| SMILES |
C1(SC2C3=C(C=CC=C3)CC=C2)C2=C(C=CC=C2)NC=C1 |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.977555 |