| SpectraBase Spectrum ID |
HUn2VYKgeQz |
| Name |
N-Tosyllysergol |
| Alternate Name(s) |
{6-[(4-methylphenyl)sulfonyl]-9,10-didehydroergolin-8-yl}methanol |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H22N2O3S |
| InChI |
InChI=1S/C22H22N2O3S/c1-14-5-7-17(8-6-14)28(26,27)24-12-15(13-25)9-19-18-3-2-4-20-22(18)16(11-23-20)10-21(19)24/h2-9,11,15,21,23,25H,10,12-13H2,1H3/t15?,21-/m1/s1 |
| InChIKey |
GILVLNNZRWRBMI-MZVUKIKXSA-N |
| Molecular Weight |
394.489 g/mol |
| SMILES |
[nH]1c2c3c(C[C@@]4(C(=CC(CO)CN4S(c4ccc(cc4)C)(=O)=O)c3ccc2)[H])c1 |
| SPLASH |
splash10-000f-4195000000-5708cf567fbaee380780 |
| Source of Spectrum |
H1-43-1510-25 |
| Wiley ID |
757881 |
