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6-(4-Methoxyphenyl)-1-methyl-3-tosyl-3-azabicyclo[4.1.0]heptan-5-one
SpectraBase Compound ID 5bKoQdh0FZy
InChI InChI=1S/C21H23NO4S/c1-15-4-10-18(11-5-15)27(24,25)22-12-19(23)21(13-20(21,2)14-22)16-6-8-17(26-3)9-7-16/h4-11H,12-14H2,1-3H3
InChIKey IZZNVUZJUPKRLD-UHFFFAOYSA-N
Mol Weight 385.48 g/mol
Molecular Formula C21H23NO4S
Exact Mass 385.134779 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KD6Jzc8FGK0
Name 6-(4-Methoxyphenyl)-1-methyl-3-tosyl-3-azabicyclo[4.1.0]heptan-5-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO4S
InChI InChI=1S/C21H23NO4S/c1-15-4-10-18(11-5-15)27(24,25)22-12-19(23)21(13-20(21,2)14-22)16-6-8-17(26-3)9-7-16/h4-11H,12-14H2,1-3H3
InChIKey IZZNVUZJUPKRLD-UHFFFAOYSA-N
Molecular Weight 385.478 g/mol
SMILES C12(C)C(C2)(C(=O)CN(S(c2ccc(cc2)C)(=O)=O)C1)c1ccc(cc1)OC
SPLASH splash10-00e9-0954000000-4401a592b161a538d785
Source of Spectrum KD-51-12819/SM11-2f
Wiley ID 1806449