| SpectraBase Spectrum ID |
1zP4IxNx5Dp |
| Name |
6H-1-Benzothiocin-6-one, 2,3,4,5-tetrahydro-3,5,5-trimethyl-3-[2-(methylthio)benzoyl]- |
| CAS Registry Number |
72360-98-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H24O2S2 |
| InChI |
InChI=1S/C22H24O2S2/c1-21(2)13-22(3,20(24)15-9-5-7-11-17(15)25-4)14-26-18-12-8-6-10-16(18)19(21)23/h5-12H,13-14H2,1-4H3 |
| InChIKey |
MHNXEPOUAUTNBQ-UHFFFAOYSA-N |
| Molecular Weight |
384.552 g/mol |
| SMILES |
C1(C(c2c(SC)cccc2)=O)(CC(C(=O)c2c(SC1)cccc2)(C)C)C |
| SPLASH |
splash10-0udi-0911000000-da2f912a0623a8515aa5 |
| Source of Spectrum |
EP-6628-0-0 |
| Synonyms |
3,5,5-trimethyl-3-[2-(methylsulfanyl)benzoyl]-2,3,4,5-tetrahydro-6H-1-benzothiocin-6-one
6,8,8-Trimethyl-6-(o-methylthiobenzoyl)-4-thia-benzocyclooctenone
3,5,5-trimethyl-3-[[2-(methylthio)phenyl]-oxomethyl]-2,4-dihydro-1-benzothiocin-6-one
3,5,5-trimethyl-3-(2-methylsulfanylbenzoyl)-2,4-dihydro-1-benzothiocin-6-one
3,5,5-trimethyl-3-(2-methylsulfanylphenyl)carbonyl-2,4-dihydro-1-benzothiocin-6-one |
| Wiley ID |
1361600 |
![6H-1-Benzothiocin-6-one, 2,3,4,5-tetrahydro-3,5,5-trimethyl-3-[2-(methylthio)benzoyl]-](/api/spectrum/1zP4IxNx5Dp/structure.png?h=300&w=458 "6H-1-Benzothiocin-6-one, 2,3,4,5-tetrahydro-3,5,5-trimethyl-3-[2-(methylthio)benzoyl]-")
