| SpectraBase Spectrum ID |
JK1LHqOVaXZ |
| Name |
2-Adamantyl-7-methyl-3-thioxo-2,8-dihydro-1,2,4-triazolo[4,3-a]pyrimidin-5-one |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H20N4OS |
| InChI |
InChI=1S/C16H20N4OS/c1-8-2-13(21)19-15(17-8)18-20(16(19)22)14-11-4-9-3-10(6-11)7-12(14)5-9/h2,9-12,14H,3-7H2,1H3,(H,17,18)/t9-,10+,11-,12+,14? |
| InChIKey |
IWOREUHOCVDMBA-QKYIQAADSA-N |
| Instrument Name |
Shimadzu GCMS-QP 2010 Ultra |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/asia.202201306 |
| Quality |
415 |
| Reported Formula |
C16H20N4OS |
| SMILES |
N1C=2N(C(N1C1[C@]3(C[C@@]4(C[C@](C3)(C[C@]1(C4)[H])[H])[H])[H])=S)C(C=C(N2)C)=O |
| SPLASH |
splash10-000i-6902000000-c99bd84323a39d80661c |
| Source of Spectrum |
CAJ-18-SM11-20d (DOI: 10.1002/asia.202201306) |
| Wiley ID |
1901175 |
![2-Adamantyl-7-methyl-3-thioxo-2,8-dihydro-1,2,4-triazolo[4,3-a]pyrimidin-5-one](/api/spectrum/JK1LHqOVaXZ/structure.png?h=300&w=458 "2-Adamantyl-7-methyl-3-thioxo-2,8-dihydro-1,2,4-triazolo[4,3-a]pyrimidin-5-one")
