| SpectraBase Spectrum ID |
2mccJlg8kro |
| Name |
Cyproheptadine |
| CAS Registry Number |
129-03-3 |
| Classification |
Pharmaceutical drug, antihistaminic |
| Comments |
Spectrum verified by crosschecking against external libraries (two reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
287.167399680 u |
| Formula |
C21H21N |
| InChI |
InChI=1S/C21H21N/c1-22-14-12-18(13-15-22)21-19-8-4-2-6-16(19)10-11-17-7-3-5-9-20(17)21/h2-11H,12-15H2,1H3 |
| InChIKey |
JJCFRYNCJDLXIK-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
287.406 g/mol |
| Nominal Mass |
287 u |
| Quality |
991 |
| Retention Index |
2366 |
| SMILES |
C1(C2=C(C=CC=3C1=CC=CC3)C=CC=C2)=C1CCN(CC1)C |
| SPLASH |
splash10-00n0-3290000000-ba61b6cad08555bd4723 |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Piperidine,4-(5H-Dibenzo[a,d]-cyclohepten-5-ylidene)-1-methyl
4-(5H-Dibenzo[a,d]-cyclohepten-5-ylidene)-1-methylpiperidine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_000844 |
