| SpectraBase Spectrum ID |
9XpxMGn3qWP |
| Name |
Ergoline-6-carbonitrile, 8-[(methylthio)methyl]-, (8.beta.)- |
| CAS Registry Number |
98988-34-2 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H19N3S |
| InChI |
InChI=1S/C17H19N3S/c1-21-9-11-5-14-13-3-2-4-15-17(13)12(7-19-15)6-16(14)20(8-11)10-18/h2-4,7,11,14,16,19H,5-6,8-9H2,1H3/t11-,14-,16-/m1/s1 |
| InChIKey |
GZIXEANONFXIBU-DJSGYFEHSA-N |
| Molecular Weight |
297.420 g/mol |
| SMILES |
[nH]1c2cccc3c2c(c1)C[C@@]1([C@@]3(C[C@](CN1C#N)(CSC)[H])[H])[H] |
| SPLASH |
splash10-0002-0090000000-cf30d4b35c873b1b8bb6 |
| Source of Spectrum |
H-68-1031-4 |
| Synonyms |
Indolo[4,3-fg]quinoline, ergoline-6-carbonitrile deriv.
(5R,8R,10R)-8-(methylthiomethyl)ergoline-6-carbonitrile
(8beta)-6-cyano-8-[(methylsulfanyl)methyl]ergoline
(6aR,9R,10aR)-9-(methylsulfanylmethyl)-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-7-carbonitrile |
| Wiley ID |
1300185 |
![Ergoline-6-carbonitrile, 8-[(methylthio)methyl]-, (8.beta.)-](/api/spectrum/9XpxMGn3qWP/structure.png?h=300&w=458 "Ergoline-6-carbonitrile, 8-[(methylthio)methyl]-, (8.beta.)-")
