| SpectraBase Spectrum ID |
4C487cHy06b |
| Name |
1-[3-Chloranyl-2-[1-chloranyl-3-(3-methylphenoxy)propan-2-yl]sulfanyl-propoxy]-3-methyl-benzene |
| Comments |
Computed using HOSE algorithm |
| Copyright |
Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
398.087406585 u |
| Formula |
C20H24Cl2O2S |
| InChI |
InChI=1S/C20H24Cl2O2S/c1-15-5-3-7-17(9-15)23-13-19(11-21)25-20(12-22)14-24-18-8-4-6-16(2)10-18/h3-10,19-20H,11-14H2,1-2H3 |
| InChIKey |
NTRZMPXIFJDBQT-UHFFFAOYSA-N |
| Molecular Weight |
399.376 g/mol |
| SMILES |
C(SC(COC=1C=C(C)C=CC1)CCl)(COC=1C=C(C)C=CC1)CCl |
![1-[3-Chloranyl-2-[1-chloranyl-3-(3-methylphenoxy)propan-2-yl]sulfanyl-propoxy]-3-methyl-benzene](/api/spectrum/4C487cHy06b/structure.png?h=300&w=458 "1-[3-Chloranyl-2-[1-chloranyl-3-(3-methylphenoxy)propan-2-yl]sulfanyl-propoxy]-3-methyl-benzene")
