| SpectraBase Spectrum ID |
ICxtCr8Av6b |
| Name |
N-(2-Adamantyl-6-fluorophenyl)pyrimidin-2-amine |
| Appearance |
Yellow solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
323.179775883 u |
| Formula |
C20H22FN3 |
| InChI |
InChI=1S/C20H22FN3/c21-17-4-1-3-16(19(17)24-20-22-5-2-6-23-20)18-14-8-12-7-13(10-14)11-15(18)9-12/h1-6,12-15,18H,7-11H2,(H,22,23,24)/t12-,13+,14-,15+,18- |
| InChIKey |
AGJYJFNSWGUSDH-NYDXYTTESA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201510743 |
| Molecular Weight |
323.415 g/mol |
| Quality |
15 |
| Reported Formula |
C20H22FN3 |
| SMILES |
N(C=1C(=CC=CC1F)C1[C@]2(C[C@]3(C[C@@]1(C[C@@](C2)(C3)[H])[H])[H])[H])C1=NC=CC=N1 |
| SPLASH |
splash10-0072-0595000000-1e2ef7d9336987f016a9 |
| Source of Spectrum |
ACI-55-SM46-5bm (DOI: 10.1002/anie.201510743) |
| Wiley ID |
1895370 |
