| SpectraBase Spectrum ID |
ALBUcSaKj8A |
| Name |
Lamotrigine |
| CAS Registry Number |
84057-84-1 |
| Classification |
Pharmaceutical drug, antiepileptic |
| Comments |
Spectrum verified by crosschecking against external libraries (one reference spectrum with similarity >= 99% found) |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
255.007850645 u |
| Formula |
C9H7Cl2N5 |
| InChI |
InChI=1S/C9H7Cl2N5/c10-5-3-1-2-4(6(5)11)7-8(12)14-9(13)16-15-7/h1-3H,(H4,12,13,14,16) |
| InChIKey |
PYZRQGJRPPTADH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
256.096 g/mol |
| Nominal Mass |
255 u |
| Quality |
977 |
| Retention Index |
2453 |
| SMILES |
NC=1N=NC(=C(N1)N)C=1C(=C(C=CC1)Cl)Cl |
| SPLASH |
splash10-052r-4920000000-7ed412f61545def69bac |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Lamictal
6-(2,3-Dichlorophenyl)-1,2,4-triazine-3,5-diamine |
| Technique |
GC/MS |
| Wiley ID |
DD2024_034067 |
