| SpectraBase Spectrum ID |
tFU4n3JLqQ |
| Name |
Pinanediol - (1S)-1-Chloroheptaneboronate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C17H30BClO2 |
| InChI |
InChI=1S/C17H30BClO2/c1-5-6-7-8-9-15(19)18-20-14-11-12-10-13(16(12,2)3)17(14,4)21-18/h12-15H,5-11H2,1-4H3/t12-,13-,14+,15+,17-/m0/s1 |
| InChIKey |
NTTGOIFQLCFTQD-XGYYKPKNSA-N |
| Molecular Weight |
312.688 g/mol |
| SMILES |
[C@@]12(C([C@@](C2)(C[C@@]2([H])OB([C@@](CCCCCC)(Cl)[H])O[C@@]12C)[H])(C)C)[H] |
| SPLASH |
splash10-05nb-5900000000-d74e928d40d50f592ebe |
| Source of Spectrum |
F5-2-43-5 |
| Synonyms |
(3aS,4S,6S,7aR)-2-((S)-1-chloroheptyl)-3a,5,5-trimethylhexahydro-4,6-methanobenzo[d][1,3,2]dioxaborole |
| Wiley ID |
1731667 |
