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6-(4-Chlorophenyl)-1-methyl-3-tosyl-3-azabicyclo[4.1.0]heptan-5-one
SpectraBase Compound ID 5fPtlGWEPIX
InChI InChI=1S/C20H20ClNO3S/c1-14-3-9-17(10-4-14)26(24,25)22-11-18(23)20(12-19(20,2)13-22)15-5-7-16(21)8-6-15/h3-10H,11-13H2,1-2H3
InChIKey FYMNYBMOKHCZSM-UHFFFAOYSA-N
Mol Weight 389.9 g/mol
Molecular Formula C20H20ClNO3S
Exact Mass 389.085242 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JczKUP58eCv
Name 6-(4-Chlorophenyl)-1-methyl-3-tosyl-3-azabicyclo[4.1.0]heptan-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C20H20ClNO3S
InChI InChI=1S/C20H20ClNO3S/c1-14-3-9-17(10-4-14)26(24,25)22-11-18(23)20(12-19(20,2)13-22)15-5-7-16(21)8-6-15/h3-10H,11-13H2,1-2H3
InChIKey FYMNYBMOKHCZSM-UHFFFAOYSA-N
Molecular Weight 389.897 g/mol
SMILES C12(C)C(C2)(C(=O)CN(S(c2ccc(cc2)C)(=O)=O)C1)c1ccc(cc1)Cl
SPLASH splash10-001l-0696000000-20d9d39a9e2c35659a33
Source of Spectrum KD-51-12819/SM11-2g
Wiley ID 1806450