| SpectraBase Spectrum ID |
JJLXD7kioBk |
| Name |
Tropisetron |
| CAS Registry Number |
89565-68-4 |
| Classification |
5-HT3-Antagonist |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
284.152477890 u |
| Formula |
C17H20N2O2 |
| InChI |
InChI=1S/C17H20N2O2/c1-19-11-6-7-12(19)9-13(8-11)21-17(20)15-10-18-16-5-3-2-4-14(15)16/h2-5,10-13,18H,6-9H2,1H3/t11-,12+,13- |
| InChIKey |
ZNRGQMMCGHDTEI-CLLJXQQHSA-N |
| Ionization Type |
Chemical Ionization (CI) |
| Molecular Weight |
284.359 g/mol |
| Nominal Mass |
284 u |
| Reagent Gas |
Methane |
| Retention Index |
2348 |
| SMILES |
C1=2C(C(O[C@]3(C[C@]4(N([C@@](C3)(CC4)[H])C)[H])[H])=O)=CNC2C=CC=C1 |
| SPLASH |
splash10-00di-0910000000-6dab236844d7dca12cf2 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
8-methyl-8-azabicyclo[3.2.1]oct-3-yl 1H-indole-3-carboxylate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_004216 |
