| SpectraBase Spectrum ID |
6eRPU7NnBms |
| Name |
N-(1-Cyclohexyl-3-phenylprop-2-yn-1-yl)-S,S-methylphenyl sulfoximine |
| Appearance |
Yellow oil |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C22H25NOS |
| InChI |
InChI=1S/C22H25NOS/c1-25(24,21-15-9-4-10-16-21)23-22(20-13-7-3-8-14-20)18-17-19-11-5-2-6-12-19/h2,4-6,9-12,15-16,20,22H,3,7-8,13-14H2,1H3 |
| InChIKey |
VRGNHIMTUOFCEB-UHFFFAOYSA-N |
| Instrument Name |
Finnigan SSQ 7000 |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201700953 |
| Molecular Weight |
351.508 g/mol |
| Quality |
42 |
| Reported Formula |
C22H25NOS |
| SMILES |
C1(S(=NC(C#CC2=CC=CC=C2)C2CCCCC2)(C)=O)=CC=CC=C1 |
| SPLASH |
splash10-014i-0290000000-aff10ad57fd423a9f53a |
| Sample Comments |
dr = 63:37 |
| Source of Spectrum |
QE-23-SM8-4x (DOI: 10.1002/chem.201700953) |
| Wiley ID |
1905769 |
