| SpectraBase Spectrum ID |
CNoeW7Gk0oc |
| Name |
tert-Butyl 4-(N-phenylphenylsulfonimidoyl)piperazine-1-carboxylate |
| Appearance |
White solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
401.177312912 u |
| Formula |
C21H27N3O3S |
| InChI |
InChI=1S/C21H27N3O3S/c1-21(2,3)27-20(25)23-14-16-24(17-15-23)28(26,19-12-8-5-9-13-19)22-18-10-6-4-7-11-18/h4-13H,14-17H2,1-3H3 |
| InChIKey |
BAVHIHMATKYKLZ-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/anie.201810548 |
| Molecular Weight |
401.525 g/mol |
| Quality |
41 |
| Reported Formula |
C21H27N3O3S |
| SMILES |
C1(S(N2CCN(CC2)C(=O)OC(C)(C)C)(=NC2=CC=CC=C2)=O)=CC=CC=C1 |
| SPLASH |
splash10-0gba-0970700000-5a2d3061e4f6a8961a53 |
| Source of Spectrum |
ACI-57-SM15-8ah (DOI: 10.1002/anie.201810548) |
| Thin-Layer Chromatography |
0.52 (pentane/EtOAc, 2:1) |
| Wiley ID |
1893597 |
