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2-(4-METHYLPHENYL)-SULFONYL-2-AZABICYCLO-[3.2.0]-HEPTANE
SpectraBase Compound ID 7M1JatE2OMY
InChI InChI=1S/C13H17NO2S/c1-10-2-5-12(6-3-10)17(15,16)14-9-8-11-4-7-13(11)14/h2-3,5-6,11,13H,4,7-9H2,1H3
InChIKey IFARYRODSGIIAR-UHFFFAOYSA-N
Mol Weight 251.34 g/mol
Molecular Formula C13H17NO2S
Exact Mass 251.098 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6FcDG5bZjRn
Name 2-(4'-methylphenyl)sulphonyl-2-azabicyclo[3.2.0]heptane
Alternate Name(s) 2-[(4-methylphenyl)sulfonyl]-2-azabicyclo[3.2.0]heptane
CAS Registry Number 137896-60-7
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO2S
InChI InChI=1S/C13H17NO2S/c1-10-2-5-12(6-3-10)17(15,16)14-9-8-11-4-7-13(11)14/h2-3,5-6,11,13H,4,7-9H2,1H3
InChIKey IFARYRODSGIIAR-UHFFFAOYSA-N
Molecular Weight 251.344 g/mol
SMILES C12N(S(c3ccc(cc3)C)(=O)=O)CCC2CC1
SPLASH splash10-06dl-9130000000-df84f3068867a6aea995
Source of Spectrum K-125-696-10
Wiley ID 1254454