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3-Bromo-2,6-dimethyl-8-phenylthiooct-6-en-2-ol
SpectraBase Compound ID LJqqrHGArof
InChI InChI=1S/C16H23BrOS/c1-13(9-10-15(17)16(2,3)18)11-12-19-14-7-5-4-6-8-14/h4-8,11,15,18H,9-10,12H2,1-3H3/b13-11+
InChIKey QUQBMSSRYXQVLK-ACCUITESSA-N
Mol Weight 343.32 g/mol
Molecular Formula C16H23BrOS
Exact Mass 342.0653 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EXfZRH8qdfZ
Name 3-Bromo-2,6-dimethyl-8-phenylthiooct-6-en-2-ol
Alternate Name(s) (6E)-3-Bromo-2,6-dimethyl-8-(phenylsulfanyl)-6-octen-2-ol (E)-3-bromanyl-2,6-dimethyl-8-phenylsulfanyl-oct-6-en-2-ol (E)-3-bromo-2,6-dimethyl-8-(phenylthio)-6-octen-2-ol (E)-3-bromo-2,6-dimethyl-8-(phenylthio)oct-6-en-2-ol (E)-3-bromo-2,6-dimethyl-8-phenylsulfanyl-oct-6-en-2-ol
CAS Registry Number 113219-35-5
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C16H23BrOS
InChI InChI=1S/C16H23BrOS/c1-13(9-10-15(17)16(2,3)18)11-12-19-14-7-5-4-6-8-14/h4-8,11,15,18H,9-10,12H2,1-3H3/b13-11+
InChIKey QUQBMSSRYXQVLK-ACCUITESSA-N
Molecular Weight 343.323 g/mol
SMILES OC(C(CC\C(=C\CSc1ccccc1)C)Br)(C)C
SPLASH splash10-001u-9510000000-834c745e38c3a876f58c
Wiley ID 1479755