| SpectraBase Spectrum ID |
3BAjtQQtSi |
| Name |
N-[2-fluoro-6-(4-phenylcyclohexyl)phenyl]pyrimidin-2-amine |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
347.179775883 u |
| Formula |
C22H22FN3 |
| InChI |
InChI=1S/C22H22FN3/c23-20-9-4-8-19(21(20)26-22-24-14-5-15-25-22)18-12-10-17(11-13-18)16-6-2-1-3-7-16/h1-9,14-15,17-18H,10-13H2,(H,24,25,26) |
| InChIKey |
OAQPFAKFWFKQFB-UHFFFAOYSA-N |
| Instrument Name |
Finnigan MAT 95 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201510743 |
| Molecular Weight |
347.437 g/mol |
| Quality |
70 |
| Reported Formula |
C22H22FN3 |
| SMILES |
N(C=1N=CC=CN1)C=1C(=CC=CC1C1CCC(CC1)C1=CC=CC=C1)F |
| SPLASH |
splash10-000b-2809000000-259ddacdf12ad4826e25 |
| Sample Comments |
trans/cis = 74:26 |
| Source of Spectrum |
ACI-55-SM52-5bn (DOI: 10.1002/anie.201510743) |
| Wiley ID |
1895371 |
![N-[2-fluoro-6-(4-phenylcyclohexyl)phenyl]pyrimidin-2-amine](/api/spectrum/3BAjtQQtSi/structure.png?h=300&w=458 "N-[2-fluoro-6-(4-phenylcyclohexyl)phenyl]pyrimidin-2-amine")
