| SpectraBase Spectrum ID |
3xyRbjS2SW |
| Name |
4-[bis(Methylthio)methyl]-1,6,8-trimethylazulene |
| Alternate Name(s) |
4-[bis(methylsulfanyl)methyl]-1,6,8-trimethylazulene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H20S2 |
| InChI |
InChI=1S/C16H20S2/c1-10-8-12(3)15-11(2)6-7-13(15)14(9-10)16(17-4)18-5/h6-9,16H,1-5H3 |
| InChIKey |
PYPNLHXMBHOUJL-UHFFFAOYSA-N |
| Molecular Weight |
276.456 g/mol |
| SMILES |
c12c(c(cc(cc2C(SC)SC)C)C)c(C)cc1 |
| SPLASH |
splash10-004i-0090000000-21fc4fb5e29784956832 |
| Source of Spectrum |
H-82-1702-18 |
| Wiley ID |
815716 |
![4-[bis(Methylthio)methyl]-1,6,8-trimethylazulene](/api/spectrum/3xyRbjS2SW/structure.png?h=300&w=458 "4-[bis(Methylthio)methyl]-1,6,8-trimethylazulene")
