| SpectraBase Spectrum ID |
KifrVG29caY |
| Name |
Methyl (R)-3-((4-methylphenyl)sulfonamido)-2-phenylpropanoate |
| Appearance |
Colorless solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
333.103479266 u |
| Formula |
C17H19NO4S |
| InChI |
InChI=1S/C17H19NO4S/c1-13-8-10-15(11-9-13)23(20,21)18-12-16(17(19)22-2)14-6-4-3-5-7-14/h3-11,16,18H,12H2,1-2H3/t16-/m0/s1 |
| InChIKey |
WPXNUVMCPAMGEI-INIZCTEOSA-N |
| Instrument Name |
JEOL JMS-DX303HF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201902009 |
| Molecular Weight |
333.402 g/mol |
| Optical Rotation |
[a]D20 = +16.5 (c = 0.5, CHCl3) |
| Quality |
151 |
| Reported Formula |
C17H19NO4S |
| SMILES |
N(S(C1=CC=C(C)C=C1)(=O)=O)C[C@](C(=O)OC)(C1=CC=CC=C1)[H] |
| SPLASH |
splash10-0zfu-2900000000-041e5c39bb7e3511b9a0 |
| Sample Comments |
94% ee |
| Source of Spectrum |
QE-25-SM22-3aa (DOI: 10.1002/chem.201902009) |
| Thin-Layer Chromatography |
0.50 (n-hexane/EtOAc, 3:1) |
| Wiley ID |
1893877 |
