| SpectraBase Spectrum ID |
Dgldblh5U0y |
| Name |
6-(1-adamantyl)-3-allyl-2-thioxo-1H-pyrimidin-4-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H22N2OS |
| InChI |
InChI=1S/C17H22N2OS/c1-2-3-19-15(20)7-14(18-16(19)21)17-8-11-4-12(9-17)6-13(5-11)10-17/h2,7,11-13H,1,3-6,8-10H2,(H,18,21)/t11-,12+,13-,17- |
| InChIKey |
ISUKPYLUVLLAQK-FBBPANFNSA-N |
| Molecular Weight |
302.436 g/mol |
| SMILES |
N1C(=CC(N(C1=S)CC=C)=O)C12C[C@]3(C[C@@](C2)(C[C@@](C1)(C3)[H])[H])[H] |
| SPLASH |
splash10-000i-0091000000-9840ce9fc5a4c26283ca |
| Source of Spectrum |
E2-46-1373-6 |
| Synonyms |
6-(1-adamantyl)-3-prop-2-enyl-2-sulfanylidene-1H-pyrimidin-4-one |
| Wiley ID |
1554603 |
