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Benzeneacetic acid, 2-[[(4-bromophenyl)sulfonyl]methyl]-alpha-(methoxymethylene)-, methyl ester
SpectraBase Compound ID KeAJJDmxEpr
InChI InChI=1S/C18H17BrO5S/c1-23-11-17(18(20)24-2)16-6-4-3-5-13(16)12-25(21,22)15-9-7-14(19)8-10-15/h3-11H,12H2,1-2H3/b17-11+
InChIKey AVDCAIMKFVSWGO-GZTJUZNOSA-N
Mol Weight 425.29 g/mol
Molecular Formula C18H17BrO5S
Exact Mass 423.998008 g/mol

Transmission Infrared (IR) Spectrum

Transmission Infrared (IR) Spectrum

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SpectraBase Spectrum ID LJVM9bHfbF3
Name Benzeneacetic acid, 2-[[(4-bromophenyl)sulfonyl]methyl]-alpha-(methoxymethylene)-, methyl ester
CAS Registry Number 131775-82-1
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Formula C18H17BrO5S
InChI InChI=1S/C18H17BrO5S/c1-23-11-17(18(20)24-2)16-6-4-3-5-13(16)12-25(21,22)15-9-7-14(19)8-10-15/h3-11H,12H2,1-2H3/b17-11+
InChIKey AVDCAIMKFVSWGO-GZTJUZNOSA-N
Instrument Name Bruker IFS 85
Purity slightly to heavily contaminated
Technique KBr-Pellet