Basic Information |
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| Product Name： | THEOBROMINE MONOHYDRIODIDE |
| CAS： | 17186-95-7 |
| English Synonyms： | THEOBROMINE MONOHYDRIODIDE |
| MDL Number.： | MFCD01682410 |
| H bond acceptor： | 6 |
| H bond donor： | 1 |
| Smile： | Cn1cnc2c1c(=O)[nH]c(=O)n2C.I |
| InChi： | InChI=1S/C7H8N4O2.HI/c1-10-3-8-5-4(10)6(12)9-7(13)11(5)2;/h3H,1-2H3,(H,9,12,13);1H |
| InChiKey： | InChIKey=YPUWHEMSDZSYIY-UHFFFAOYSA-N |
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