| SpectraBase Spectrum ID |
I2AF7QNBsdj |
| Name |
2H-1-Benzothiocin-3-methanol, 3,4,5,6-tetrahydro-6-hydroxy-3,5,5-trimethyl-.alpha.-[2-(methylthio)phenyl]- |
| Alternate Name(s) |
3-(Hydroxy[2-(methylsulfanyl)phenyl]methyl)-3,5,5-trimethyl-3,4,5,6-tetrahydro-2H-1-benzothiocin-6-ol
3,5,5-trimethyl-3-[(2-methylsulfanylphenyl)-oxidanyl-methyl]-4,6-dihydro-2H-1-benzothiocin-6-ol
3-[hydroxy-(2-methylsulfanylphenyl)methyl]-3,5,5-trimethyl-4,6-dihydro-2H-1-benzothiocin-6-ol
3-[hydroxy-[2-(methylthio)phenyl]methyl]-3,5,5-trimethyl-4,6-dihydro-2H-1-benzothiocin-6-ol |
| CAS Registry Number |
72360-99-7 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H28O2S2 |
| InChI |
InChI=1S/C22H28O2S2/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/h5-12,19-20,23-24H,13-14H2,1-4H3 |
| InChIKey |
PWWFKNKVBFGUJI-UHFFFAOYSA-N |
| Molecular Weight |
388.584 g/mol |
| SMILES |
OC1C(CC(C(c2ccccc2SC)O)(C)CSc2ccccc12)(C)C |
| SPLASH |
splash10-03di-0910000000-32f24dd58b06ffeeceb0 |
| Source of Spectrum |
EP-6629-0-0 |
| Wiley ID |
1363836 |
![2H-1-Benzothiocin-3-methanol, 3,4,5,6-tetrahydro-6-hydroxy-3,5,5-trimethyl-.alpha.-[2-(methylthio)phenyl]-](/api/spectrum/I2AF7QNBsdj/structure.png?h=300&w=458 "2H-1-Benzothiocin-3-methanol, 3,4,5,6-tetrahydro-6-hydroxy-3,5,5-trimethyl-.alpha.-[2-(methylthio)phenyl]-")
