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acetamide, 2-[[(4-bromophenyl)sulfonyl](phenylmethyl)amino]-N-[(tetrahydro-2-furanyl)methyl]-
SpectraBase Compound ID A6UoM1IZDst
InChI InChI=1S/C20H23BrN2O4S/c21-17-8-10-19(11-9-17)28(25,26)23(14-16-5-2-1-3-6-16)15-20(24)22-13-18-7-4-12-27-18/h1-3,5-6,8-11,18H,4,7,12-15H2,(H,22,24)
InChIKey SPXOYBFUFDNGEZ-UHFFFAOYSA-N
Mol Weight 467.38 g/mol
Molecular Formula C20H23BrN2O4S
Exact Mass 466.056191 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID GrsjrSYGkJ3
Name Acetamide, 2-[[(4-bromophenyl)sulfonyl](phenylmethyl)amino]-N-[(tetrahydro-2-furanyl)methyl]-
Comments Computed using HOSE algorithm
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Exact Mass 466.056191399 u
Formula C20H23BrN2O4S
InChI InChI=1S/C20H23BrN2O4S/c21-17-8-10-19(11-9-17)28(25,26)23(14-16-5-2-1-3-6-16)15-20(24)22-13-18-7-4-12-27-18/h1-3,5-6,8-11,18H,4,7,12-15H2,(H,22,24)
InChIKey SPXOYBFUFDNGEZ-UHFFFAOYSA-N
Molecular Weight 467.378 g/mol
SMILES N(C(CN(S(C1=CC=C(C=C1)Br)(=O)=O)CC1=CC=CC=C1)=O)CC1OCCC1