SpectraBase Spectrum ID |
Jp8VbSDgAzk |
Name |
2,2,4-Triphenyl-3,4-dihydro-2H-thiopyran |
Comments |
Computed using SmartSpectra Model v1.42 |
Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
Exact Mass |
328.128571818 u |
Formula |
C23H20S |
InChI |
InChI=1S/C23H20S/c1-4-10-19(11-5-1)20-16-17-24-23(18-20,21-12-6-2-7-13-21)22-14-8-3-9-15-22/h1-17,20H,18H2 |
InChIKey |
FSPMBRXXLHCWCZ-UHFFFAOYSA-N |
Molecular Weight |
328.473 g/mol |
SMILES |
C1(CC(C=2C=CC=CC2)C=CS1)(C1=CC=CC=C1)C=1C=CC=CC1 |
Spectrum/Structure Validation Score (Vapor Phase IR) |
0.989452 |