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(1R,3S,4S,5S,6S,9R)-5-Bromo-3-hydroxy-4,9-dimethyl-7-oxabicyclo[4.3.0]nonane

View entire compound with spectra: 1 MS (GC)

(1R,3S,4S,5S,6S,9R)-5-Bromo-3-hydroxy-4,9-dimethyl-7-oxabicyclo[4.3.0]nonane
SpectraBase Compound ID LMSR3TUkVmQ
InChI InChI=1S/C10H17BrO2/c1-5-4-13-10-7(5)3-8(12)6(2)9(10)11/h5-10,12H,3-4H2,1-2H3/t5-,6-,7+,8-,9-,10-/m0/s1
InChIKey KUTPGWGRIBBMGQ-FOVGZEBNSA-N
Mol Weight 249.15 g/mol
Molecular Formula C10H17BrO2
Exact Mass 248.041193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9zBsfUAQH5l
Name (1R,3S,4S,5S,6S,9R)-5-Bromo-3-hydroxy-4,9-dimethyl-7-oxabicyclo[4.3.0]nonane
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H17BrO2
InChI InChI=1S/C10H17BrO2/c1-5-4-13-10-7(5)3-8(12)6(2)9(10)11/h5-10,12H,3-4H2,1-2H3/t5-,6-,7+,8-,9-,10-/m0/s1
InChIKey KUTPGWGRIBBMGQ-FOVGZEBNSA-N
Molecular Weight 249.148 g/mol
SMILES O[C@@]1([C@@]([C@@]([C@@]2([C@](C1)([C@@](C)(CO2)[H])[H])[H])(Br)[H])(C)[H])[H]
SPLASH splash10-0002-9110000000-83605d9787a6538d39c0
Source of Spectrum E1-39-2520-19
Synonyms (3R,3aR,5S,6S,7S,7aS)-7-bromo-3,6-dimethyloctahydro-1-benzofuran-5-ol
Wiley ID 1519056