| SpectraBase Spectrum ID |
GmMTVKBrEtZ |
| Name |
1-[[Bis(methylthio)methylene]acetyl]-2-(4-phenyl-1,3-butadienyl)cyclopropane |
| Alternate Name(s) |
3,3-bis(methylsulfanyl)-1-{2-[(1E,3E)-4-phenyl-1,3-butadienyl]cyclopropyl}-2-propen-1-one |
| CAS Registry Number |
139378-12-4 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C18H20OS2 |
| InChI |
InChI=1S/C18H20OS2/c1-20-18(21-2)13-17(19)16-12-15(16)11-7-6-10-14-8-4-3-5-9-14/h3-11,13,15-16H,12H2,1-2H3/b10-6+,11-7+ |
| InChIKey |
GBWGZERYCRPYHU-JMQWPVDRSA-N |
| Molecular Weight |
316.477 g/mol |
| SMILES |
C1(CC1\C=C\C=C\c1ccccc1)C(C=C(SC)SC)=O |
| SPLASH |
splash10-0udi-0009000000-c46df17655f556676597 |
| Source of Spectrum |
J-57-2261-10 |
| Wiley ID |
1316750 |
![1-[[Bis(methylthio)methylene]acetyl]-2-(4-phenyl-1,3-butadienyl)cyclopropane](/api/spectrum/GmMTVKBrEtZ/structure.png?h=300&w=458 "1-[[Bis(methylthio)methylene]acetyl]-2-(4-phenyl-1,3-butadienyl)cyclopropane")
