| SpectraBase Spectrum ID |
EX4dZnBdLDZ |
| Name |
3,3-Dimethyl-2,2-bis-[4-methoxy-phenyl]-4-isopropylidene-thietane |
| Comments |
Computed using SmartSpectra Model v1.42 |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
354.165351249 u |
| Formula |
C22H26O2S |
| InChI |
InChI=1S/C22H26O2S/c1-15(2)20-21(3,4)22(25-20,16-7-11-18(23-5)12-8-16)17-9-13-19(24-6)14-10-17/h7-14H,1-6H3 |
| InChIKey |
QOHGWGTTXOQUFW-UHFFFAOYSA-N |
| Molecular Weight |
354.508 g/mol |
| SMILES |
C1(SC(C1(C)C)(C1=CC=C(C=C1)OC)C1=CC=C(C=C1)OC)=C(C)C |
| Spectrum/Structure Validation Score (Vapor Phase IR) |
0.954958 |
![3,3-Dimethyl-2,2-bis-[4-methoxy-phenyl]-4-isopropylidene-thietane](/api/spectrum/EX4dZnBdLDZ/structure.png?h=300&w=458 "3,3-Dimethyl-2,2-bis-[4-methoxy-phenyl]-4-isopropylidene-thietane")
