SpectraBase Compound ID | DXDtkWOGoTH |
---|---|
InChI | InChI=1S/C42H69ClO12Si8/c43-35-31-29-34(30-32-35)33-56-44-57(36-15-1-2-16-36)47-60(39-21-7-8-22-39)49-58(45-56,37-17-3-4-18-37)51-62(41-25-11-12-26-41)52-59(46-56,38-19-5-6-20-38)50-61(48-57,40-23-9-10-24-40)54-63(53-60,55-62)42-27-13-14-28-42/h29-32,36-42H,1-28,33H2 |
InChIKey | KDAMIASBEBBZQK-UHFFFAOYSA-N |
Mol Weight | 1026.1 g/mol |
Molecular Formula | C42H69ClO12Si8 |
Exact Mass | 1024.263168 g/mol |
SpectraBase Spectrum ID | BEurALkPmcU |
---|---|
Name | PSS-(4-(Chloromethyl)phenyl)-Heptacyclopentyl substituted |
Source of Sample | Sigma-Aldrich Co. LLC. |
Catalog Number | 521809 |
Copyright | Copyright © 2021-2024 Sigma-Aldrich Co. LLC. - Database Compilation Copyright © 2021 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C42H69ClO12Si8 |
InChI | InChI=1S/C42H69ClO12Si8/c43-35-31-29-34(30-32-35)33-56-44-57(36-15-1-2-16-36)47-60(39-21-7-8-22-39)49-58(45-56,37-17-3-4-18-37)51-62(41-25-11-12-26-41)52-59(46-56,38-19-5-6-20-38)50-61(48-57,40-23-9-10-24-40)54-63(53-60,55-62)42-27-13-14-28-42/h29-32,36-42H,1-28,33H2 |
InChIKey | KDAMIASBEBBZQK-UHFFFAOYSA-N |
Molecular Weight | 1026.135 g/mol |
Observed nucleus | 13C |
Solvent | CDCl3 |
Source of Spectrum | Sigma-Aldrich Co. LLC. |
Wiley ID | SIAL_13CNMR_015089 |