![3,6,8-Trimethyl-5,7-dioxo-5,6,7,8-tetrahydro-1H-pyrazolo[4',3':5,6]pyrido[2,3-d]pyrimidin-4-yl acetate](/api/spectrum/5l58JHzQqNq/structure.png?h=300&w=458 "3,6,8-Trimethyl-5,7-dioxo-5,6,7,8-tetrahydro-1H-pyrazolo[4',3':5,6]pyrido[2,3-d]pyrimidin-4-yl acetate")
| SpectraBase Compound ID | DAqaA2inzCT |
|---|---|
| InChI | InChI=1S/C13H13N5O4/c1-5-7-9(22-6(2)19)8-11(14-10(7)16-15-5)17(3)13(21)18(4)12(8)20/h1-4H3,(H,14,15,16) |
| InChIKey | IBEPKOKEPSZDIV-UHFFFAOYSA-N |
| Mol Weight | 303.28 g/mol |
| Molecular Formula | C13H13N5O4 |
| Exact Mass | 303.096754 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 5l58JHzQqNq |
|---|---|
| Name | 3,6,8-Trimethyl-5,7-dioxo-5,6,7,8-tetrahydro-1H-pyrazolo[4',3':5,6]pyrido[2,3-d]pyrimidin-4-yl acetate |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C13H13N5O4 |
| InChI | InChI=1S/C13H13N5O4/c1-5-7-9(22-6(2)19)8-11(14-10(7)16-15-5)17(3)13(21)18(4)12(8)20/h1-4H3,(H,14,15,16) |
| InChIKey | IBEPKOKEPSZDIV-UHFFFAOYSA-N |
| Molecular Weight | 303.278 g/mol |
| SMILES | [nH]1nc(c2c1nc1c(c2OC(=O)C)C(N(C(N1C)=O)C)=O)C |
| SPLASH | splash10-03dl-9260000000-730752f8b501d13b04e0 |
| Synonyms | Acetic acid (3,6,8-trimethyl-5,7-dioxo-5,6,7,8-tetrahydro-1H-1,2,6,8,9-pentaazacyclopenta[b]naphthalen-4-yl) ester Acetic acid (3,6,8-trimethyl-5,7-dioxo-2H-pyrazolo[1,2]pyrido[4,5-b]pyrimidin-4-yl) ester (3,6,8-trimethyl-5,7-dioxo-2H-pyrazolo[1,2]pyrido[4,5-b]pyrimidin-4-yl) acetate [3,6,8-trimethyl-5,7-bis(oxidanylidene)-2H-pyrazolo[1,2]pyrido[4,5-b]pyrimidin-4-yl] ethanoate |
| Wiley ID | 1437258 |