| SpectraBase Spectrum ID |
33T7ia8fVNh |
| Name |
(5S,6S)-5-Bromo-5-fluoro-6-(2-methoxyethoxy)methoxy-7-methyl-3-propyl-4-octanol |
| Comments |
Edited after expert review for CH2Cl2 contamination - Original record with SpectrumID 774753 moved to the Legacy library |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C16H32BrFO4 |
| InChI |
InChI=1S/C16H32BrFO4/c1-6-8-13(7-2)14(19)16(17,18)15(12(3)4)22-11-21-10-9-20-5/h12-15,19H,6-11H2,1-5H3/t13?,14?,15-,16+/m0/s1 |
| InChIKey |
SUHAHARRHVBJPM-SSHXOBKSSA-N |
| Molecular Weight |
387.330 g/mol |
| SMILES |
OC([C@@]([C@](C(C)C)(OCOCCOC)[H])(Br)F)C(CC)CCC |
| SPLASH |
splash10-000i-9200000000-5b742da9ebb0195307cd |
| Source of Spectrum |
AJ-71-2918-22 |
| Synonyms |
(3S,4S)-4-bromo-6-ethyl-4-fluoro-3-[(2-methoxyethoxy)methoxy]-2-methyl-5-nonanol
5-Bromo-15-fluoro-6-(2-methoxyethoxy)methoxy-7-methyl-3-propyl-4-octanol |
| Wiley ID |
1821071 |
