![7-(4-heptylphenyl)-1,3-dimethyl-1H,2H,3H,4H-purino[8,7-b][1,3]oxazole-2,4-dione](/api/spectrum/KFrIuwtgdKM/structure.png?h=300&w=458 "7-(4-heptylphenyl)-1,3-dimethyl-1H,2H,3H,4H-purino[8,7-b][1,3]oxazole-2,4-dione")
| SpectraBase Compound ID | 39vp93Sb2Zg |
|---|---|
| InChI | InChI=1S/C22H26N4O3/c1-4-5-6-7-8-9-15-10-12-16(13-11-15)17-14-26-18-19(23-21(26)29-17)24(2)22(28)25(3)20(18)27/h10-14H,4-9H2,1-3H3 |
| InChIKey | XIPWJVURLKPGIR-UHFFFAOYSA-N |
| Mol Weight | 394.48 g/mol |
| Molecular Formula | C22H26N4O3 |
| Exact Mass | 394.200491 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KFrIuwtgdKM |
|---|---|
| Name | 7-(4-heptylphenyl)-1,3-dimethyl-1H,2H,3H,4H-purino[8,7-b][1,3]oxazole-2,4-dione |
| Copyright | Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H26N4O3 |
| InChI | InChI=1S/C22H26N4O3/c1-4-5-6-7-8-9-15-10-12-16(13-11-15)17-14-26-18-19(23-21(26)29-17)24(2)22(28)25(3)20(18)27/h10-14H,4-9H2,1-3H3 |
| InChIKey | XIPWJVURLKPGIR-UHFFFAOYSA-N |
| Molecular Weight | 394.475 g/mol |
| SMILES | c12c(nc3[n]2C=C(c2ccc(cc2)CCCCCCC)O3)N(C)C(N(C1=O)C)=O |
| SPLASH | splash10-052f-3519000000-deb4db820cda6fe4b78e |
| Source of Spectrum | IY-2-5198-9 |
| Synonyms | Oxazolo[2,3-f]purine-2,4(1H,3H)-dione, 7-(4-heptylphenyl)-1,3-dimethyl- 7-(4-heptylphenyl)-1,3-dimethyl[1,3]oxazolo[2,3-f]purine-2,4(1H,3H)-dione 7-(4-heptylphenyl)-2,4-dimethylpurino[8,7-b]oxazole-1,3-dione 7-(4-heptylphenyl)-2,4-dimethylpurino[8,7-b][1,3]oxazole-1,3-dione 7-(4-heptylphenyl)-2,4-dimethyl-purino[8,7-b]oxazole-1,3-dione 7-(4-heptylphenyl)-2,4-dimethyl-purino[8,7-b][1,3]oxazole-1,3-dione |
| Wiley ID | 1659972 |