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2-(4'-methylphenyl)sulphonyl-2-azabicyclo[3.2.0]hept-6-ene
SpectraBase Compound ID JwMQZ88NOSt
InChI InChI=1S/C13H15NO2S/c1-10-2-5-12(6-3-10)17(15,16)14-9-8-11-4-7-13(11)14/h2-7,11,13H,8-9H2,1H3
InChIKey ARYYSZLDRGXIOO-UHFFFAOYSA-N
Mol Weight 249.33 g/mol
Molecular Formula C13H15NO2S
Exact Mass 249.08235 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EgYWRu5wzo
Name 2-(4'-methylphenyl)sulphonyl-2-azabicyclo[3.2.0]hept-6-ene
Alternate Name(s) 2-[(4-methylphenyl)sulfonyl]-2-azabicyclo[3.2.0]hept-6-ene
CAS Registry Number 137896-59-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H15NO2S
InChI InChI=1S/C13H15NO2S/c1-10-2-5-12(6-3-10)17(15,16)14-9-8-11-4-7-13(11)14/h2-7,11,13H,8-9H2,1H3
InChIKey ARYYSZLDRGXIOO-UHFFFAOYSA-N
Molecular Weight 249.328 g/mol
SMILES C12N(S(c3ccc(cc3)C)(=O)=O)CCC2C=C1
SPLASH splash10-00kf-9000000000-e238fd0c0178f5785d8e
Source of Spectrum K-125-696-9
Wiley ID 1252098