| SpectraBase Spectrum ID |
1eVud1Uj6dJ |
| Name |
1-[4-(1H-Pyrazol-1-yl)-2-(endo-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl)phenyl]ethan-1-one |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H26N2O |
| InChI |
InChI=1S/C21H26N2O/c1-14(24)17-7-6-16(23-11-5-10-22-23)13-18(17)19-12-15-8-9-21(19,4)20(15,2)3/h5-7,10-11,13,15,19H,8-9,12H2,1-4H3/t15-,19-,21+/m0/s1 |
| InChIKey |
QDIQZFGQKXFJAP-PAXLWEDBSA-N |
| Instrument Name |
Jeol AccuTOF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.202007144 |
| Molecular Weight |
322.452 g/mol |
| Reported Formula |
C21H26N2O |
| SMILES |
c1c(cc([C@@]2(C[C@]3(C([C@@]2(CC3)C)(C)C)[H])[H])c(c1)C(C)=O)-[n]1cccn1 |
| SPLASH |
splash10-03di-0290000000-c7a631ff28a6e5df2b70 |
| Source of Spectrum |
ACI-59-SM52-endo-7fj |
| Wiley ID |
1858347 |
![1-[4-(1H-Pyrazol-1-yl)-2-(endo-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl)phenyl]ethan-1-one](/api/spectrum/1eVud1Uj6dJ/structure.png?h=300&w=458 "1-[4-(1H-Pyrazol-1-yl)-2-(endo-1,7,7-trimethylbicyclo[2.2.1]heptan-2-yl)phenyl]ethan-1-one")
