| SpectraBase Spectrum ID |
9SLQ3bk9I |
| Name |
Phenyl 7-cyclohexyl-9-azabicyclo[4.2.1]nona-2,4,7-triene-9-carboxylate |
| Appearance |
Yellowish oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H23NO2 |
| InChI |
InChI=1S/C21H23NO2/c23-21(24-18-12-5-2-6-13-18)22-17-11-7-8-14-20(22)19(15-17)16-9-3-1-4-10-16/h2,5-8,11-17,20H,1,3-4,9-10H2/t17-,20+/m1/s1 |
| InChIKey |
NVMJOTRKUGHWIL-XLIONFOSSA-N |
| Instrument Name |
Shimadzu GC??MS-QP2010 Plus |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/ejoc.201901837 |
| Molecular Weight |
321.420 g/mol |
| Reported Formula |
C21H23NO2 |
| SMILES |
C=1([C@@]2(C=CC=C[C@](C1)(N2C(=O)Oc1ccccc1)[H])[H])C1CCCCC1 |
| SPLASH |
splash10-05rc-9240000000-f2c93860438ec7895523 |
| Source of Spectrum |
U1-2020-SM17-3bq |
| Thin-Layer Chromatography |
Rf = 0.52 (petroleum ether/ethyl acetate 15:1, 10:1, 5:1) |
| Wiley ID |
1858978 |
![Phenyl 7-cyclohexyl-9-azabicyclo[4.2.1]nona-2,4,7-triene-9-carboxylate](/api/spectrum/9SLQ3bk9I/structure.png?h=300&w=458 "Phenyl 7-cyclohexyl-9-azabicyclo[4.2.1]nona-2,4,7-triene-9-carboxylate")
