![(4bS,8aS)-1,3-Dimethyl-(octahydro)benzofuro[2,3-d]pyrimidine-2,4(1H,3H)-dione](/api/spectrum/EQq6WAQIQDv/structure.png?h=300&w=458 "(4bS,8aS)-1,3-Dimethyl-(octahydro)benzofuro[2,3-d]pyrimidine-2,4(1H,3H)-dione")
| SpectraBase Compound ID | BfEbIkUrukp |
|---|---|
| InChI | InChI=1S/C12H16N2O3/c1-13-10(15)9-7-5-3-4-6-8(7)17-11(9)14(2)12(13)16/h7-8H,3-6H2,1-2H3/t7-,8+/m1/s1 |
| InChIKey | ODGQYABFAXEAOL-SFYZADRCSA-N |
| Mol Weight | 236.27 g/mol |
| Molecular Formula | C12H16N2O3 |
| Exact Mass | 236.116092 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | EQq6WAQIQDv |
|---|---|
| Name | (4bS,8aS)-1,3-Dimethyl-(octahydro)benzofuro[2,3-d]pyrimidine-2,4(1H,3H)-dione |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C12H16N2O3 |
| InChI | InChI=1S/C12H16N2O3/c1-13-10(15)9-7-5-3-4-6-8(7)17-11(9)14(2)12(13)16/h7-8H,3-6H2,1-2H3/t7-,8+/m1/s1 |
| InChIKey | ODGQYABFAXEAOL-SFYZADRCSA-N |
| Molecular Weight | 236.271 g/mol |
| SMILES | C12=C(C(=O)N(C(N2C)=O)C)[C@@]2(CCCC[C@@]2(O1)[H])[H] |
| SPLASH | splash10-000f-0890000000-805a1a0253ebf686e303 |
| Source of Spectrum | SK-30-4286-3 |
| Synonyms | (4bS,8aS)-1,3-Dimethyl-4b,5,6,7,8,8a-hexahydro-benzofuro[2,3-d]pyrimidine-2,4(1H,3H)-dione (4bS,8aS)-1,3-dimethyl-4b,5,6,7,8,8a-hexahydro[1]benzofuro[2,3-d]pyrimidine-2,4(1H,3H)-dione 1,3-Dimethyl-(octahydro)benzofuro[2,3-d]pyrimidine-2,4(1H,3H)-dione 1,3-Dimethyl-4b,5,6,7,8,8a-hexahydro-benzofuro[2,3-d]pyrimidine-2,4(1H,3H)-dione (4bS,8aS)-1,3-dimethyl-4b,5,6,7,8,8a-hexahydrobenzofuro[2,3-d]pyrimidine-2,4-dione (4bS,8aS)-1,3-dimethyl-4b,5,6,7,8,8a-hexahydro-[1]benzofuro[2,3-d]pyrimidine-2,4-dione |
| Wiley ID | 881662 |