| SpectraBase Spectrum ID |
9F518bkJyAA |
| Name |
Methyl (R)-3-((4-methylphenyl)sulfonamido)-2-(2-naphthyl)propanoate |
| Appearance |
Colorless solid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Exact Mass |
383.119129330 u |
| Formula |
C21H21NO4S |
| InChI |
InChI=1S/C21H21NO4S/c1-15-7-11-19(12-8-15)27(24,25)22-14-20(21(23)26-2)18-10-9-16-5-3-4-6-17(16)13-18/h3-13,20,22H,14H2,1-2H3/t20-/m0/s1 |
| InChIKey |
DJUNBQJWNPCAFS-FQEVSTJZSA-N |
| Instrument Name |
JEOL JMS-DX303HF |
| Ionization Type |
EI |
| Literature Reference DOI |
10.1002/chem.201902009 |
| Molecular Weight |
383.462 g/mol |
| Optical Rotation |
[a]D20 = +5.4 (c = 0.5, CHCl3) |
| Quality |
96 |
| Reported Formula |
C21H21NO4S |
| SMILES |
N(S(C1=CC=C(C)C=C1)(=O)=O)C[C@](C(=O)OC)(C1=CC=C2C(=C1)C=CC=C2)[H] |
| SPLASH |
splash10-0udi-1390000000-3f258dce4f46a0b95019 |
| Sample Comments |
92% ee |
| Source of Spectrum |
QE-25-SM24-3ah (DOI: 10.1002/chem.201902009) |
| Thin-Layer Chromatography |
0.36 (n-hexane/EtOAc, 3:2) |
| Wiley ID |
1893880 |
