| SpectraBase Spectrum ID |
BAOGQ4e3bxI |
| Name |
#1;7-ALPHA,8-ALPHA-EPOXY-THEONELLIN-ISOTHIOCYANATE;(2S,3S)-2-[(1R,4S)-4-ISOTHIOCYANATO-4-METHYLCYCLOHEXYL]-2-METHYL-3-[(E)-3-METHYLBUT-1-ENYL]-OXIRANE) |
| Copyright |
Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
| Formula |
C16H25NOS |
| InChI |
InChI=1S/C16H25NOS/c1-12(2)5-6-14-16(4,18-14)13-7-9-15(3,10-8-13)17-11-19/h5-6,12-14H,7-10H2,1-4H3/b6-5+/t13-,14-,15-,16-/m0/s1 |
| InChIKey |
KDUAXUPCJBAPHQ-GLGJLECESA-N |
| Literature Reference Author |
C.M.KONDEMPUDI,R.SINGANABOINA,N.MANCHALA,V.G.GUNDA,V.R.JANAP
ALA,V.YENAMANDRA |
| Literature Reference Citation |
CHEM.PHARM.BULL.,57,990(2009) |
| Literature Reference DOI |
10.1248/cpb.57.990 |
| Molecular Weight |
279.441 g/mol |
| Sample ID |
2906 |
| Solvent |
CDCl3 |
![#1;7-ALPHA,8-ALPHA-EPOXY-THEONELLIN-ISOTHIOCYANATE;(2S,3S)-2-[(1R,4S)-4-ISOTHIOCYANATO-4-METHYLCYCLOHEXYL]-2-METHYL-3-[(E)-3-METHYLBUT-1-ENYL]-OXIRANE)](/api/spectrum/BAOGQ4e3bxI/structure.png?h=300&w=458 "#1;7-ALPHA,8-ALPHA-EPOXY-THEONELLIN-ISOTHIOCYANATE;(2S,3S)-2-[(1R,4S)-4-ISOTHIOCYANATO-4-METHYLCYCLOHEXYL]-2-METHYL-3-[(E)-3-METHYLBUT-1-ENYL]-OXIRANE)")
