| SpectraBase Spectrum ID |
5J76vNADCPq |
| Name |
Ethanone, 1-[6-(2-methyl-1,3-dithian-2-yl)-2,4-cyclohexadien-1-yl]-, trans- |
| CAS Registry Number |
89568-55-8 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C13H18OS2 |
| InChI |
InChI=1S/C13H18OS2/c1-10(14)11-6-3-4-7-12(11)13(2)15-8-5-9-16-13/h3-4,6-7,11-12H,5,8-9H2,1-2H3/t11-,12+/m1/s1 |
| InChIKey |
RZRDZCJTEVDKTD-NEPJUHHUSA-N |
| Molecular Weight |
254.406 g/mol |
| SMILES |
C1([C@@]2([C@@](C(=O)C)(C=CC=C2)[H])[H])(SCCCS1)C |
| SPLASH |
splash10-001i-0900000000-57b0d2eb11f7d3f5cc1e |
| Source of Spectrum |
H-73-398-7 |
| Synonyms |
1-[(1S,6S)-6-(2-methyl-1,3-dithian-2-yl)-2,4-cyclohexadien-1-yl]ethanone
1-[6-(2-methyl-1,3-dithian-2-yl)cyclohexa-2,4-dien-1-yl]ethanone |
| Wiley ID |
1257471 |
![Ethanone, 1-[6-(2-methyl-1,3-dithian-2-yl)-2,4-cyclohexadien-1-yl]-, trans-](/api/spectrum/5J76vNADCPq/structure.png?h=300&w=458 "Ethanone, 1-[6-(2-methyl-1,3-dithian-2-yl)-2,4-cyclohexadien-1-yl]-, trans-")
