| SpectraBase Spectrum ID |
JIVTehKdgkC |
| Name |
Proxyphylline AC |
| Classification |
Pharmaceutical drug derivative |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
280.117155007 u |
| Formula |
C12H16N4O4 |
| InChI |
InChI=1S/C12H16N4O4/c1-7(20-8(2)17)5-16-6-13-10-9(16)11(18)15(4)12(19)14(10)3/h6-7H,5H2,1-4H3 |
| InChIKey |
BMKYBGZBTOVPRI-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
280.284 g/mol |
| Nominal Mass |
280 u |
| Quality |
987 |
| Retention Index |
2261 |
| SMILES |
C12=C(N(C(N(C2=O)C)=O)C)N=CN1CC(OC(=O)C)C |
| SPLASH |
splash10-0006-9530000000-20e1a9040535e271ff4a |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
1-(1,3-dimethyl-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl)propan-2-yl acetate |
| Technique |
GC/MS |
| Wiley ID |
DD2024_009969 |
