SpectraBase Spectrum ID |
4TnLljJS1w |
Name |
tert-Butyl 2-{1-[chloro(p-tolylsulfinyl)methyl]cyclopentadecyl}hexanoate |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C33H55ClO3S |
InChI |
InChI=1S/C33H55ClO3S/c1-6-7-20-29(30(35)37-32(3,4)5)33(31(34)38(36)28-23-21-27(2)22-24-28)25-18-16-14-12-10-8-9-11-13-15-17-19-26-33/h21-24,29,31H,6-20,25-26H2,1-5H3 |
InChIKey |
HPERKWPHVAPTPO-UHFFFAOYSA-N |
Molecular Weight |
567.313 g/mol |
SMILES |
C(C1(C(C(OC(C)(C)C)=O)CCCC)CCCCCCCCCCCCCC1)(S(c1ccc(cc1)C)=O)Cl |
SPLASH |
splash10-05n3-5589100000-40e6cb27c264b1095699 |
Source of Spectrum |
F-59-4332-8d |
Wiley ID |
1712234 |