SpectraBase Spectrum ID |
C3CZF7CPSdq |
Name |
[(4S)-4-methyl-11-(2-methyl-1,3-dithian-2-yl)undecyl] methanesulfonate |
Appearance |
Color oil |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C18H36O3S3 |
InChI |
InChI=1S/C18H36O3S3/c1-17(12-9-14-21-24(3,19)20)11-7-5-4-6-8-13-18(2)22-15-10-16-23-18/h17H,4-16H2,1-3H3/t17-/m0/s1 |
InChIKey |
BTLFTGMVNVHMGG-KRWDZBQOSA-N |
Ionization Type |
EI |
Molecular Weight |
396.663 g/mol |
Optical Rotation |
[a]D26 = 0.70 (c = 0.85, CHCl3) |
SMILES |
C(CCC[C@@](CCCOS(=O)(=O)C)(C)[H])CCCC1(C)SCCCS1 |
SPLASH |
splash10-001i-0900000000-9e57c7a18ce111c12c63 |
Source of Spectrum |
CN101050211B |
Wiley ID |
1841417 |