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N-Methoxycarbonyl-2-exo-(phenylsulfanyl)-8-azabicyclo[3.2.1]octan-3-one
SpectraBase Compound ID DLkEXlOgvV7
InChI InChI=1S/C15H17NO3S/c1-19-15(18)16-10-7-8-12(16)14(13(17)9-10)20-11-5-3-2-4-6-11/h2-6,10,12,14H,7-9H2,1H3/t10-,12+,14?/m1/s1
InChIKey IRJVDUQGRDHYBJ-RBOJZIDYSA-N
Mol Weight 291.37 g/mol
Molecular Formula C15H17NO3S
Exact Mass 291.092915 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9ZZp1cUaIQf
Name N-Methoxycarbonyl-2-exo-(phenylsulfanyl)-8-azabicyclo[3.2.1]octan-3-one
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H17NO3S
InChI InChI=1S/C15H17NO3S/c1-19-15(18)16-10-7-8-12(16)14(13(17)9-10)20-11-5-3-2-4-6-11/h2-6,10,12,14H,7-9H2,1H3/t10-,12+,14?/m1/s1
InChIKey IRJVDUQGRDHYBJ-RBOJZIDYSA-N
Molecular Weight 291.365 g/mol
SMILES [C@@]12(N([C@@](CC(C2Sc2ccccc2)=O)(CC1)[H])C(=O)OC)[H]
SPLASH splash10-004i-0910000000-b4d9328b3449f9d5bc84
Source of Spectrum KC-0-3693-14
Synonyms Methyl 3-oxo-2-(phenylsulfanyl)-8-azabicyclo[3.2.1]octane-8-carboxylate
Wiley ID 826966