| SpectraBase Compound ID | 1tTbtxwjYm2 |
|---|---|
| InChI | InChI=1S/C15H28B2O6/c1-4-6-8-16-19-10-11-12(21-16)13-14(15(18-3)20-11)23-17(22-13)9-7-5-2/h11-15H,4-10H2,1-3H3/t11-,12-,13+,14+,15+/m1/s1 |
| InChIKey | LLZHQYVRINZQGL-MRLBHPIUSA-N |
| Mol Weight | 326.0 g/mol |
| Molecular Formula | C15H28B2O6 |
| Exact Mass | 326.207199 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | KbVqFEVEN9o |
|---|---|
| Name | .alpha.-D-Mannopyranoside, methyl, cyclic 2,3:4,6-bis(butylboronate) |
| CAS Registry Number | 54400-84-9 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C15H28B2O6 |
| InChI | InChI=1S/C15H28B2O6/c1-4-6-8-16-19-10-11-12(21-16)13-14(15(18-3)20-11)23-17(22-13)9-7-5-2/h11-15H,4-10H2,1-3H3/t11-,12-,13+,14+,15+/m1/s1 |
| InChIKey | LLZHQYVRINZQGL-MRLBHPIUSA-N |
| Molecular Weight | 326.003 g/mol |
| SMILES | [C@]12([C@](OB(O2)CCCC)([C@@](OC)(O[C@]2([C@]1(OB(OC2)CCCC)[H])[H])[H])[H])[H] |
| SPLASH | splash10-004m-9400000000-8a67b5c3f277ee8705cf |
| Source of Spectrum | EP-1539-0-0 |
| Synonyms | (3aS,4S,5aR,9aS,9bS)-2,8-dibutyl-4-methoxyhexahydro[1,3,2]dioxaborolo[4',5':4,5]pyrano[3,2-d][1,3,2]dioxaborin (3aS,4S,5aR,9aS,9bS)-2,8-dibutylhexahydro[1,3,2]dioxaborolo[4',5':4,5]pyrano[3,2-d][1,3,2]dioxaborin-4-yl methyl ether A-mannopyranoside-1-methyl-2,3-4,6-di-butylboronate |
| Wiley ID | 1324541 |