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1-(2-bromanylhex-5-enylsulfonyl)-4-methyl-benzene

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1-(2-bromanylhex-5-enylsulfonyl)-4-methyl-benzene
SpectraBase Compound ID 4nP0fPqhC1Y
InChI InChI=1S/C13H17BrO2S/c1-3-4-5-12(14)10-17(15,16)13-8-6-11(2)7-9-13/h3,6-9,12H,1,4-5,10H2,2H3
InChIKey PGNCUBQPLQBHFG-UHFFFAOYSA-N
Mol Weight 317.24 g/mol
Molecular Formula C13H17BrO2S
Exact Mass 316.013264 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3n3wDlGSgop
Name 1-(2-bromanylhex-5-enylsulfonyl)-4-methyl-benzene
Alternate Name(s) 1-(2-bromohex-5-enylsulfonyl)-4-methyl-benzene
CAS Registry Number 129110-98-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17BrO2S
InChI InChI=1S/C13H17BrO2S/c1-3-4-5-12(14)10-17(15,16)13-8-6-11(2)7-9-13/h3,6-9,12H,1,4-5,10H2,2H3
InChIKey PGNCUBQPLQBHFG-UHFFFAOYSA-N
Molecular Weight 317.241 g/mol
SMILES C(S(c1ccc(cc1)C)(=O)=O)C(Br)CCC=C
SPLASH splash10-001i-9100000000-b8c1fe6f3e6742d410b0
Source of Spectrum F-46-3068-7
Wiley ID 1316372