| SpectraBase Compound ID | BDSowZ3OLiY |
|---|---|
| InChI | InChI=1S/C24H31BrO8/c25-20-5-6-23-24(19-20)33-18-14-29-10-9-27-12-16-31-22-4-2-1-3-21(22)30-15-11-26-7-8-28-13-17-32-23/h1-6,19H,7-18H2 |
| InChIKey | CUDFNOUCOAHASY-UHFFFAOYSA-N |
| Mol Weight | 527.41 g/mol |
| Molecular Formula | C24H31BrO8 |
| Exact Mass | 526.120231 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | IyvIma8d5v2 |
|---|---|
| Name | DB24-C8Br |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C24H31BrO8 |
| InChI | InChI=1S/C24H31BrO8/c25-20-5-6-23-24(19-20)33-18-14-29-10-9-27-12-16-31-22-4-2-1-3-21(22)30-15-11-26-7-8-28-13-17-32-23/h1-6,19H,7-18H2 |
| InChIKey | CUDFNOUCOAHASY-UHFFFAOYSA-N |
| Molecular Weight | 527.408 g/mol |
| SMILES | c12cc(ccc2OCCOCCOCCOc2c(OCCOCCOCCO1)cccc2)Br |
| SPLASH | splash10-004r-0930050000-03652a63c22cc5ba106c |
| Source of Spectrum | F5-4-229-7 |
| Synonyms | 4-Bromo-dibenzo-24-crown-8 2-Bromo-6,7,9,10,12,13,20,21,23,24,26,27-dodecahydrodibenzo[b,n][1,4,7,10,13,16,19,22]octaoxacyclotetracosine |
| Wiley ID | 1732693 |