| SpectraBase Compound ID | 7sH6sZyqF6C |
|---|---|
| InChI | InChI=1S/C22H30BNO7/c24-23(30-20-6-1-2-7-21(20)31-23)22-18-4-3-5-19(22)17-29-15-13-27-11-9-25-8-10-26-12-14-28-16-18/h1-7H,8-17H2,24H3 |
| InChIKey | JIEUJGIGCNNBAB-UHFFFAOYSA-N |
| Mol Weight | 431.3 g/mol |
| Molecular Formula | C22H30BNO7 |
| Exact Mass | 431.211532 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | AKeW3Lhj1MR |
|---|---|
| Name | 1,3-Xylyl-18-krone-5, 2-(benzo-1,3,2-dioxaborol-2-yl)-, *(15)NH3 |
| Alternate Name(s) | 1,3-Xylyl-18-krone-5, 2-(benzo-1,3,2-dioxaborol-2-yl)-, *NH3 1,3-Xylyl-18-krone-5,2-(benzo-1,3,2-dioxaborol-2-yl)-, *(15)NH3 1,3-Xylyl-18-krone-5,2-(benzo-1,3,2-dioxaborol-2-yl)-, *NH3 2-Azaniumyl-2-{3,6,9,12,15-pentaoxabicyclo[15.3.1]henicosa-1(21),17,19-trien-21-yl}-2H-1,3,2-benzodioxaborol-2-uide |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C22H30BNO7 |
| InChI | InChI=1S/C22H30BNO7/c24-23(30-20-6-1-2-7-21(20)31-23)22-18-4-3-5-19(22)17-29-15-13-27-11-9-25-8-10-26-12-14-28-16-18/h1-7H,8-17H2,24H3 |
| InChIKey | JIEUJGIGCNNBAB-UHFFFAOYSA-N |
| Molecular Weight | 431.292 g/mol |
| SMILES | c1([B-]2([NH3+])Oc3c(O2)cccc3)c2cccc1COCCOCCOCCOCCOC2 |
| SPLASH | splash10-03ki-3970200000-f126dd740b2fc2c3d801 |
| Wiley ID | 1490806 |