| SpectraBase Spectrum ID |
GVYh3ovq3nc |
| Name |
Benaphyllin |
| CAS Registry Number |
5878-61-5 |
| Classification |
Pharmaceutical drug, broncholytic |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
242.057053308 u |
| Formula |
C9H11ClN4O2 |
| InChI |
InChI=1S/C9H11ClN4O2/c1-12-7-6(8(15)13(2)9(12)16)14(4-3-10)5-11-7/h5H,3-4H2,1-2H3 |
| InChIKey |
QCIARNIKNKKHFH-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
242.666 g/mol |
| Nominal Mass |
242 u |
| Quality |
891 |
| Retention Index |
1989 |
| SMILES |
C12=C(N(C(N(C2=O)C)=O)C)N=CN1CCCl |
| SPLASH |
splash10-05o4-9760000000-fe45ad7c179dd9689bbd |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Eupnophile
7-(2-Chloroethyl)-1,3-dimethylpurine-2,6-dione |
| Technique |
GC/MS |
| Wiley ID |
DD2024_007903 |
