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1-[5-bromo-3-(1,3-dithian-2-yl)-2-fluorophenyl]cyclohexan-1-ol
SpectraBase Compound ID KI43gQkyRIA
InChI InChI=1S/C16H20BrFOS2/c17-11-9-12(15-20-7-4-8-21-15)14(18)13(10-11)16(19)5-2-1-3-6-16/h9-10,15,19H,1-8H2
InChIKey VGKVQFZDYOJDNG-UHFFFAOYSA-N
Mol Weight 391.36 g/mol
Molecular Formula C16H20BrFOS2
Exact Mass 390.012299 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KkPlVjduV4p
Name 1-{5'-Bromo-3'-([1,3]dithian-2''-yl)-2-fluorophenyl}-cyclohexanol
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H20BrFOS2
InChI InChI=1S/C16H20BrFOS2/c17-11-9-12(15-20-7-4-8-21-15)14(18)13(10-11)16(19)5-2-1-3-6-16/h9-10,15,19H,1-8H2
InChIKey VGKVQFZDYOJDNG-UHFFFAOYSA-N
Molecular Weight 391.357 g/mol
SMILES OC1(c2c(c(C3SCCCS3)cc(Br)c2)F)CCCCC1
SPLASH splash10-0595-4309000000-4911f977bf1bdfcdd973
Source of Spectrum F5-3-3230-13
Synonyms 1-(5-bromo-3-(1,3-dithian-2-yl)-2-fluorophenyl)cyclohexanol 1-[5-bromo-3-(1,3-dithian-2-yl)-2-fluorophenyl]-1-cyclohexanol 1-[5-bromo-3-(1,3-dithian-2-yl)-2-fluorophenyl]cyclohexan-1-ol 1-[5-bromanyl-3-(1,3-dithian-2-yl)-2-fluoranyl-phenyl]cyclohexan-1-ol
Wiley ID 1732473