| SpectraBase Spectrum ID |
L2KNItqYCSa |
| Name |
(2R)-6-chloro-2-heptyl-3-methylene-1-(p-tolylsulfonyl)indoline |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H28ClNO2S |
| InChI |
InChI=1S/C23H28ClNO2S/c1-4-5-6-7-8-9-22-18(3)21-15-12-19(24)16-23(21)25(22)28(26,27)20-13-10-17(2)11-14-20/h10-16,22H,3-9H2,1-2H3/t22-/m1/s1 |
| InChIKey |
BMMOJVOQTUFDSP-JOCHJYFZSA-N |
| Ionization Type |
EI |
| Molecular Weight |
417.995 g/mol |
| Optical Rotation |
[a]D20 = +140.7 (c = 0.85, ethyl acetate) |
| Reported Formula |
C23H28(35)ClNO2S |
| SMILES |
c1cc2c(cc1Cl)N([C@@](C2=C)(CCCCCCC)[H])S(c1ccc(cc1)C)(=O)=O |
| SPLASH |
splash10-0006-9000000000-175c2e0750705e1ef362 |
| Sample Comments |
95% ee |
| Source of Spectrum |
CN101671313B |
| Wiley ID |
1844616 |
