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1-Methyl-6-(p-tolyl)-3-tosyl-3-azabicyclo[4.1.0]heptan-5-one
SpectraBase Compound ID LT6hIyMtf3k
InChI InChI=1S/C21H23NO3S/c1-15-4-8-17(9-5-15)21-13-20(21,3)14-22(12-19(21)23)26(24,25)18-10-6-16(2)7-11-18/h4-11H,12-14H2,1-3H3
InChIKey KPGAUBHTCHBTGE-UHFFFAOYSA-N
Mol Weight 369.48 g/mol
Molecular Formula C21H23NO3S
Exact Mass 369.139865 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AZpTiYFBwa6
Name 1-Methyl-6-(p-tolyl)-3-tosyl-3-azabicyclo[4.1.0]heptan-5-one
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H23NO3S
InChI InChI=1S/C21H23NO3S/c1-15-4-8-17(9-5-15)21-13-20(21,3)14-22(12-19(21)23)26(24,25)18-10-6-16(2)7-11-18/h4-11H,12-14H2,1-3H3
InChIKey KPGAUBHTCHBTGE-UHFFFAOYSA-N
Molecular Weight 369.479 g/mol
SMILES C12(C)C(C2)(C(=O)CN(S(c2ccc(cc2)C)(=O)=O)C1)c1ccc(cc1)C
SPLASH splash10-0aos-0094000000-6164eb2bc06c2674cb12
Source of Spectrum KD-51-12819/SM10-2e
Wiley ID 1806448