| SpectraBase Spectrum ID |
9LAFqBHh1WV |
| Name |
1-Butyl-8-(hexahydro-2,5-methanopentalen-3a-yl)-3-(3-hydroxypropyl)-3,7-dihydropurine-2,6-dione |
| Copyright |
Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H30N4O3 |
| InChI |
InChI=1S/C21H30N4O3/c1-2-3-5-25-18(27)16-17(24(20(25)28)6-4-7-26)23-19(22-16)21-11-13-8-14(12-21)10-15(21)9-13/h13-15,26H,2-12H2,1H3,(H,22,23)/t13-,14+,15?,21? |
| InChIKey |
CIBIXJYFYPFMTN-UHFFFAOYSA-N |
| Molecular Weight |
386.496 g/mol |
| SMILES |
OCCCN1c2c(C(N(C1=O)CCCC)=O)[nH]c(n2)C12C3C[C@](C2)(C[C@](C1)(C3)[H])[H] |
| SPLASH |
splash10-000i-0039000000-b6d67f0fc225f3f2d098 |
| Source of Spectrum |
F-59-52-4e |
| Wiley ID |
1676654 |
