| SpectraBase Spectrum ID |
HVwaYLwQ6hM |
| Name |
7-Hexyl-3-methyl-8-sulfanyl-3,7-dihydro-1H-purine-2,6-dione |
| CAS Registry Number |
126118-62-5 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H18N4O2S |
| InChI |
InChI=1S/C12H18N4O2S/c1-3-4-5-6-7-16-8-9(13-12(16)19)15(2)11(18)14-10(8)17/h3-7H2,1-2H3,(H,13,19)(H,14,17,18) |
| InChIKey |
UXIHCIYDMGYKSF-UHFFFAOYSA-N |
| Molecular Weight |
282.362 g/mol |
| SMILES |
Sc1nc2N(C(NC(c2[n]1CCCCCC)=O)=O)C |
| SPLASH |
splash10-0005-9640000000-481f0e1c58a4f0f2f1ec |
| Source of Spectrum |
AD-0-2532-0 |
| Synonyms |
7-Hexyl-3-methyl-8-sulfanylidene-9H-purine-2,6-dione
7-Hexyl-3-methyl-8-thioxo-9H-purine-2,6-dione
7-Hexyl-3-methyl-8-thioxo-9H-purine-2,6-quinone
Imidazo[4,5-d]pyrimidin-5,7(4H,6H)-dione, 1-hexyl-4-methyl-2-mercapto- |
| Wiley ID |
1420997 |
