| SpectraBase Spectrum ID |
IrpWE32rpXS |
| Name |
1-(4-chloro-2-nitro-phenyl)piperidine-4-carbonitrile |
| Appearance |
Light orange solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C12H12ClN3O2 |
| InChI |
InChI=1S/C12H12ClN3O2/c13-10-1-2-11(12(7-10)16(17)18)15-5-3-9(8-14)4-6-15/h1-2,7,9H,3-6H2 |
| InChIKey |
BKKNHBBBTGFDLD-UHFFFAOYSA-N |
| Instrument Name |
Varian GCMS Saturn 2100 T |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201812068 |
| Molecular Weight |
265.700 g/mol |
| Reported Formula |
C12H13ClN3O2 |
| SMILES |
c1c(c(ccc1Cl)N1CCC(CC1)C#N)[N+]([O-])=O |
| SPLASH |
splash10-00mk-0790000000-f709e3ed1bad978b0a00 |
| Source of Spectrum |
ACI-58-SM16-3dd |
| Wiley ID |
1840442 |
