| SpectraBase Spectrum ID |
GW4wojDh1RQ |
| Name |
Sulfaguanol |
| CAS Registry Number |
27031-08-9 |
| Classification |
Pharmaceutical drug, chemotherapeutic |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
309.089560534 u |
| Formula |
C12H15N5O3S |
| InChI |
InChI=1S/C12H15N5O3S/c1-7-8(2)20-12(15-7)16-11(14)17-21(18,19)10-5-3-9(13)4-6-10/h3-6H,13H2,1-2H3,(H3,14,15,16,17) |
| InChIKey |
IJZUQDQOAFUFJY-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
309.344 g/mol |
| Nominal Mass |
309 u |
| Quality |
921 |
| SMILES |
NC=1C=CC(S(NC(NC=2OC(=C(N2)C)C)=N)(=O)=O)=CC1 |
| SPLASH |
splash10-0a4i-2922000000-7dca8f5ee211a922f6af |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
2-(4-Aminophenyl)sulfonyl-1-(4,5-dimethyl-1,3-oxazol-2-yl)guanidine |
| Technique |
DI/MS |
| Wiley ID |
DD2024_003929 |
