SpectraBase Compound ID | 2pCKD54zPXy |
---|---|
InChI | InChI=1S/C28H38I2O4/c29-27-23-15-13-17-25(27)33-21-11-7-3-4-8-12-22-34-26-18-14-16-24(28(26)30)32-20-10-6-2-1-5-9-19-31-23/h13-18H,1-12,19-22H2 |
InChIKey | QBZIGBJSCLQGSB-UHFFFAOYSA-N |
Mol Weight | 692.4 g/mol |
Molecular Formula | C28H38I2O4 |
Exact Mass | 692.08595 g/mol |
SpectraBase Spectrum ID | LV8SEX8LCsT |
---|---|
Name | 16,32-Diiodo-1,10,17,26-Tetraoxa[10.10]metacyclophane |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C28H38I2O4 |
InChI | InChI=1S/C28H38I2O4/c29-27-23-15-13-17-25(27)33-21-11-7-3-4-8-12-22-34-26-18-14-16-24(28(26)30)32-20-10-6-2-1-5-9-19-31-23/h13-18H,1-12,19-22H2 |
InChIKey | QBZIGBJSCLQGSB-UHFFFAOYSA-N |
Molecular Weight | 692.417 g/mol |
SMILES | c1(c2OCCCCCCCCOc3cccc(c3I)OCCCCCCCCOc1ccc2)I |
SPLASH | splash10-0006-0040009000-82856e6cb7454aac9faa |
Source of Spectrum | KC-0-536-8 |
Synonyms | 31,32-Diiodo-2,11,17,26-tetraoxa-tricyclo[25.3.1.1*12,16*]dotriaconta-1(30),12,14,16(32),27(31),28-hexaene 31,32-diiodo-2,11,17,26-tetraoxatricyclo[25.3.1.1(12,16)]dotriaconta-1(31),12(32),13,15,27,29-hexaene |
Wiley ID | 824327 |