| SpectraBase Spectrum ID |
KQjj9BF0kSs |
| Name |
3,3-bis[(Methoxycarbonyl)methylthio]-2-(phenylsulfinyl)acrylonitrile |
| Alternate Name(s) |
methyl {[2-cyano-1-[(2-methoxy-2-oxoethyl)sulfanyl]-2-(phenylsulfinyl)vinyl]sulfanyl}acetate |
| CAS Registry Number |
139427-25-1 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C15H15NO5S3 |
| InChI |
InChI=1S/C15H15NO5S3/c1-20-13(17)9-22-15(23-10-14(18)21-2)12(8-16)24(19)11-6-4-3-5-7-11/h3-7H,9-10H2,1-2H3 |
| InChIKey |
HYFIVKAVRWOPMM-UHFFFAOYSA-N |
| Molecular Weight |
385.467 g/mol |
| SMILES |
C(C(=C(SCC(=O)OC)SCC(=O)OC)S(=O)c1ccccc1)#N |
| SPLASH |
splash10-004r-0906000000-c3861f1b43d332d006d8 |
| Source of Spectrum |
U-1992-396-3 |
| Wiley ID |
764195 |
![3,3-bis[(Methoxycarbonyl)methylthio]-2-(phenylsulfinyl)acrylonitrile](/api/spectrum/KQjj9BF0kSs/structure.png?h=300&w=458 "3,3-bis[(Methoxycarbonyl)methylthio]-2-(phenylsulfinyl)acrylonitrile")
