| SpectraBase Spectrum ID |
L0TSjvrIjJi |
| Name |
cis-Tetrahydro-2,4,6-triphenylthiopyran-4^A-ol |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
346.139136501 u |
| Formula |
C23H22OS |
| InChI |
InChI=1S/C23H22OS/c24-23(20-14-8-3-9-15-20)16-21(18-10-4-1-5-11-18)25-22(17-23)19-12-6-2-7-13-19/h1-15,21-22,24H,16-17H2/t21-,22+,23? |
| InChIKey |
PQGUOFJCYNVNAT-AIZNXBIQSA-N |
| Molecular Weight |
346.488 g/mol |
| SMILES |
OC1(C[C@@](S[C@](C2=CC=CC=C2)(C1)[H])(C1=CC=CC=C1)[H])C=1C=CC=CC1 |
| Spectrum/Structure Validation Score (Raman) |
0.995841 |
