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1-phenylsulfonyl-2-bromomethyl-1H-indol-3-carboxaldehyde
SpectraBase Compound ID LmKukEhMLxc
InChI InChI=1S/C16H12BrNO3S/c17-10-16-14(11-19)13-8-4-5-9-15(13)18(16)22(20,21)12-6-2-1-3-7-12/h1-9,11H,10H2
InChIKey QLOOCCVAKZRMSV-UHFFFAOYSA-N
Mol Weight 378.24 g/mol
Molecular Formula C16H12BrNO3S
Exact Mass 376.972127 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3vPCyYd0PpR
Name 1-phenylsulfonyl-2-bromomethyl-1H-indol-3-carboxaldehyde
Comments Less than 3 mono-isotopic peaks
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Formula C16H12BrNO3S
InChI InChI=1S/C16H12BrNO3S/c17-10-16-14(11-19)13-8-4-5-9-15(13)18(16)22(20,21)12-6-2-1-3-7-12/h1-9,11H,10H2
InChIKey QLOOCCVAKZRMSV-UHFFFAOYSA-N
Molecular Weight 378.240 g/mol
SMILES c1(S([n]2c(c(C=O)c3c2cccc3)CBr)(=O)=O)ccccc1
SPLASH splash10-004i-0009000000-ab74041f44fc1ba8c9fd
Source of Spectrum U1-2011-929-6
Synonyms 1-(benzenesulfonyl)-2-(bromomethyl)-3-indolecarboxaldehyde 1-(benzenesulfonyl)-2-(bromomethyl)indole-3-carbaldehyde 2-(bromomethyl)-1-(phenylsulfonyl)indole-3-carbaldehyde
Wiley ID 1664937