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7-(4-METHYLPHENYL)-SULFONYLOXY-1-AZABICYCLO-[2.2.1]-HEPTANE
SpectraBase Compound ID 5ft1st1smQD
InChI InChI=1S/C13H17NO3S/c1-10-2-4-12(5-3-10)18(15,16)17-13-11-6-8-14(13)9-7-11/h2-5,11,13H,6-9H2,1H3
InChIKey OBKRMNAZAIZDAK-UHFFFAOYSA-N
Mol Weight 267.34 g/mol
Molecular Formula C13H17NO3S
Exact Mass 267.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID EClVcYc1xqJ
Name 7-(4'-methylphenyl)sulphonyloxy-1-azabicyclo[2.2.1]heptane
Alternate Name(s) 1-Azabicyclo[2.2.1]hept-7-yl 4-methylbenzenesulfonate
CAS Registry Number 137896-62-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C13H17NO3S
InChI InChI=1S/C13H17NO3S/c1-10-2-4-12(5-3-10)18(15,16)17-13-11-6-8-14(13)9-7-11/h2-5,11,13H,6-9H2,1H3
InChIKey OBKRMNAZAIZDAK-UHFFFAOYSA-N
Molecular Weight 267.343 g/mol
SMILES C1(OS(c2ccc(cc2)C)(=O)=O)N2CCC1CC2
SPLASH splash10-0ced-9320000000-32362944f7f0b9667b38
Source of Spectrum K-125-697-14
Wiley ID 1271044