| SpectraBase Spectrum ID |
H7jkH1Qa5Xv |
| Name |
2-(4'-Methylbenzoyl)-3,3-bis(methylthio)-2-propenal |
| CAS Registry Number |
138696-49-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H14O2S2 |
| InChI |
InChI=1S/C13H14O2S2/c1-9-4-6-10(7-5-9)12(15)11(8-14)13(16-2)17-3/h4-8H,1-3H3 |
| InChIKey |
OMALGZXBAYDTTJ-UHFFFAOYSA-N |
| Molecular Weight |
266.373 g/mol |
| SMILES |
C(C(c1ccc(cc1)C)=O)(=C(SC)SC)C=O |
| SPLASH |
splash10-014i-0900000000-e7dc123d18fce80400d2 |
| Source of Spectrum |
U-1992-389-3 |
| Synonyms |
2-(4-methylbenzoyl)-3,3-bis(methylsulfanyl)acrylaldehyde
2-[(4-methylphenyl)-oxomethyl]-3,3-bis(methylthio)-2-propenal
2-(4-methylbenzoyl)-3,3-bis(methylsulfanyl)prop-2-enal
2-(4-methylphenyl)carbonyl-3,3-bis(methylsulfanyl)prop-2-enal |
| Wiley ID |
764223 |
