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(+-)-7-Chlorosulfonyl-3-fluoromethyl-3,4-dihydroisoquinolin-1(2H)-one
SpectraBase Compound ID 7egh8NycNT9
InChI InChI=1S/C10H9ClFNO3S/c11-17(15,16)8-2-1-6-3-7(5-12)13-10(14)9(6)4-8/h1-2,4,7H,3,5H2,(H,13,14)
InChIKey PTBHATGROQLQBV-UHFFFAOYSA-N
Mol Weight 277.7 g/mol
Molecular Formula C10H9ClFNO3S
Exact Mass 276.99757 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DJTh7fP9mFZ
Name (+-)-7-Chlorosulfonyl-3-fluoromethyl-3,4-dihydroisoquinolin-1(2H)-one
Alternate Name(s) 3-(fluoromethyl)-1-oxo-1,2,3,4-tetrahydro-7-isoquinolinesulfonyl chloride 3-(fluoromethyl)-1-oxo-3,4-dihydro-2H-isoquinoline-7-sulfonyl chloride 3-(fluoranylmethyl)-1-oxidanylidene-3,4-dihydro-2H-isoquinoline-7-sulfonyl chloride
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Formula C10H9ClFNO3S
InChI InChI=1S/C10H9ClFNO3S/c11-17(15,16)8-2-1-6-3-7(5-12)13-10(14)9(6)4-8/h1-2,4,7H,3,5H2,(H,13,14)
InChIKey PTBHATGROQLQBV-UHFFFAOYSA-N
Molecular Weight 277.697 g/mol
SMILES N1C(Cc2c(C1=O)cc(cc2)S(=O)(=O)Cl)CF
SPLASH splash10-002n-4690000000-1b5cf676679525b43524
Source of Spectrum F2-42-3595-31
Wiley ID 1600401