| SpectraBase Spectrum ID |
9FpX2GLEWBN |
| Name |
Thioureum |
| Alternate Name(s) |
1(N)-Tosyl-2-[3''-(t-butyldiphenylsilyl)oxy]-10-[(triethylsilyl)oxy]-8-[2'-(methylthio)ethyl]-1,5,7-triazadeca-6-thione
1(N)-Tosyl-2-[3''-(t-butyldiphenylsilyl)oxy]-10-[(triethylsilyl)oxy]-8-[2'-(methylthio)ethyl]-1,5,7-triazadeca-6-thione |
| Comments |
Note: The molecular formula of the structure shown is C39H61N3O4S3Si2 - which differs from the formula reported for the mass spectrum (C42H58N3O4S3Si2) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C42H58N3O4S3Si2 |
| InChI |
InChI=1S/C39H61N3O4S3Si2/c1-9-50(10-2,11-3)45-30-27-33(28-31-48-8)41-38(47)40-29-26-37(42-49(43,44)34-24-22-32(4)23-25-34)46-51(39(5,6)7,35-18-14-12-15-19-35)36-20-16-13-17-21-36/h12-25,33,37,42H,9-11,26-31H2,1-8H3,(H2,40,41,47) |
| InChIKey |
ABWORBHZLHEBPA-UHFFFAOYSA-N |
| Molecular Weight |
788.284 g/mol |
| SMILES |
N(S(c1ccc(cc1)C)(=O)=O)C(CCNC(NC(CCO[Si](CC)(CC)CC)CCSC)=S)O[Si](C(C)(C)C)(c1ccccc1)c1ccccc1 |
| SPLASH |
splash10-03xr-9510000000-fa6ee7c30afbf501f5f5 |
| Source of Spectrum |
AN-106-619-10 |
| Wiley ID |
747697 |
