| SpectraBase Spectrum ID |
2EfXzgoPUe |
| Name |
Methyl 3-methyl-5-oxy-2-phenoxyhexanedithioate |
| CAS Registry Number |
123520-45-6 |
| Comments |
Edited after expert review for air contamination - Original record with SpectrumID 1285586 moved to the Legacy library |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18O2S2 |
| InChI |
InChI=1S/C14H18O2S2/c1-10(9-11(2)15)13(14(17)18-3)16-12-7-5-4-6-8-12/h4-8,10,13H,9H2,1-3H3 |
| InChIKey |
XXFXEPWTOBWBQD-UHFFFAOYSA-N |
| Molecular Weight |
282.416 g/mol |
| SMILES |
C(C(=S)SC)(C(CC(=O)C)C)Oc1ccccc1 |
| SPLASH |
splash10-0006-8930000000-6d98af7034aa18ae760f |
| Source of Spectrum |
F-45-2053-37 |
| Synonyms |
Methyl 3-methyl-5-oxo-2-phenoxyhexanedithioate |
| Wiley ID |
1820980 |
