| SpectraBase Spectrum ID |
C9uwOdzoDlJ |
| Name |
2-(1-Adamantylthio)pyrimidine-4(3H)-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C14H18N2OS |
| InChI |
InChI=1S/C14H18N2OS/c17-12-1-2-15-13(16-12)18-14-6-9-3-10(7-14)5-11(4-9)8-14/h1-2,9-11H,3-8H2,(H,15,16,17)/t9-,10+,11-,14- |
| InChIKey |
FZSSMEOTWRPVSY-UAMPICCDSA-N |
| Molecular Weight |
262.371 g/mol |
| SMILES |
N1C(C=CN=C1SC12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H])=O |
| SPLASH |
splash10-03dr-0690000000-cbde345f9a4797a413a5 |
| Source of Spectrum |
F2-46-741-5e |
| Synonyms |
2-(1-adamantylsulfanyl)-1H-pyrimidin-6-one |
| Wiley ID |
1690029 |
