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2-[4'-(N,N-Dimethylamino)phenyl]thio-cyclohexanol
SpectraBase Compound ID GnVn0LiRt4U
InChI InChI=1S/C14H21NOS/c1-15(2)11-7-9-12(10-8-11)17-14-6-4-3-5-13(14)16/h7-10,13-14,16H,3-6H2,1-2H3/t13-,14-/m1/s1
InChIKey DRAJQHYDGWYXDS-ZIAGYGMSSA-N
Mol Weight 251.39 g/mol
Molecular Formula C14H21NOS
Exact Mass 251.134385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 1qkMzQ4gOND
Name 2-[4'-(N,N-Dimethylamino)phenyl]thio-cyclohexanol
Alternate Name(s) (1R,2R)-2-(4-Dimethylamino-phenylsulfanyl)-cyclohexanol 2-{[4-(Dimethylamino)phenyl]sulfanyl}cyclohexanol (1R,2R)-2-[[4-(dimethylamino)phenyl]thio]-1-cyclohexanol (1R,2R)-2-[4-(dimethylamino)phenyl]sulfanylcyclohexanol (1R,2R)-2-[4-(dimethylamino)phenyl]sulfanylcyclohexan-1-ol
Comments Less than 3 mono-isotopic peaks
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Formula C14H21NOS
InChI InChI=1S/C14H21NOS/c1-15(2)11-7-9-12(10-8-11)17-14-6-4-3-5-13(14)16/h7-10,13-14,16H,3-6H2,1-2H3/t13-,14-/m1/s1
InChIKey DRAJQHYDGWYXDS-ZIAGYGMSSA-N
Molecular Weight 251.388 g/mol
SMILES O[C@]1([C@](Sc2ccc(cc2)N(C)C)(CCCC1)[H])[H]
SPLASH splash10-0udi-0950000000-279509075621d4337ced
Source of Spectrum SK-28-920-6
Wiley ID 868369