| SpectraBase Spectrum ID |
59ojCSI122R |
| Name |
Benzene, 1-methoxy-4-[4-(4-oxiranyl)butyl]-2-(4-phenylthiomethylphenoxy)- |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
420.175915933 u |
| Formula |
C26H28O3S |
| InChI |
InChI=1S/C26H28O3S/c1-27-25-16-13-20(7-5-6-8-23-18-28-23)17-26(25)29-22-14-11-21(12-15-22)19-30-24-9-3-2-4-10-24/h2-4,9-17,23H,5-8,18-19H2,1H3 |
| InChIKey |
FKUOVAVPFBDZHO-UHFFFAOYSA-N |
| Molecular Weight |
420.567 g/mol |
| SMILES |
C1OC1CCCCC1=CC(OC2=CC=C(C=C2)CSC=2C=CC=CC2)=C(C=C1)OC |
![Benzene, 1-methoxy-4-[4-(4-oxiranyl)butyl]-2-(4-phenylthiomethylphenoxy)-](/api/spectrum/59ojCSI122R/structure.png?h=300&w=458 "Benzene, 1-methoxy-4-[4-(4-oxiranyl)butyl]-2-(4-phenylthiomethylphenoxy)-")
