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1-((2-fluorophenyl)thio)octan-2-ol
SpectraBase Compound ID 9ur2URCdsyH
InChI InChI=1S/C14H21FOS/c1-2-3-4-5-8-12(16)11-17-14-10-7-6-9-13(14)15/h6-7,9-10,12,16H,2-5,8,11H2,1H3
InChIKey NDQJFCSFPMXMSZ-UHFFFAOYSA-N
Mol Weight 256.38 g/mol
Molecular Formula C14H21FOS
Exact Mass 256.129715 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KszkLG3CsET
Name 1-((2-fluorophenyl)thio)octan-2-ol
Alternate Name(s) 1-[(2-fluorophenyl)thio]-2-octanol 1-(2-fluorophenyl)sulfanyloctan-2-ol
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21FOS
InChI InChI=1S/C14H21FOS/c1-2-3-4-5-8-12(16)11-17-14-10-7-6-9-13(14)15/h6-7,9-10,12,16H,2-5,8,11H2,1H3
InChIKey NDQJFCSFPMXMSZ-UHFFFAOYSA-N
Literature Reference DOI 10.1039/b600620e
Molecular Weight 256.379 g/mol
SMILES OC(CSc1c(cccc1)F)CCCCCC
SPLASH splash10-0a4u-0290000000-0446bd6a00750fda33ec
Source of Spectrum GCH-8-330/SM6-1t
Wiley ID 1760607