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2-(2-Methoxy-5-pyridyl)-7-(p-toluenesulfonyl)-7-azabicyclo[2.2.1]hept-2-ene
SpectraBase Compound ID 2LQPAt8XC38
InChI InChI=1S/C19H20N2O3S/c1-13-3-7-16(8-4-13)25(22,23)21-15-6-9-18(21)17(11-15)14-5-10-19(24-2)20-12-14/h3-5,7-8,10-12,15,18H,6,9H2,1-2H3/t15-,18+/m0/s1
InChIKey ALSZTSDTDDUAGC-MAUKXSAKSA-N
Mol Weight 356.44 g/mol
Molecular Formula C19H20N2O3S
Exact Mass 356.119464 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DBd4qGXVSBN
Name 2-(2-Methoxy-5-pyridyl)-7-(p-toluenesulfonyl)-7-azabicyclo[2.2.1]hept-2-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C19H20N2O3S
InChI InChI=1S/C19H20N2O3S/c1-13-3-7-16(8-4-13)25(22,23)21-15-6-9-18(21)17(11-15)14-5-10-19(24-2)20-12-14/h3-5,7-8,10-12,15,18H,6,9H2,1-2H3/t15-,18+/m0/s1
InChIKey ALSZTSDTDDUAGC-MAUKXSAKSA-N
Molecular Weight 356.440 g/mol
SMILES [C@]12(C(=C[C@](CC2)(N1S(=O)(=O)c1ccc(cc1)C)[H])c1ccc(nc1)OC)[H]
SPLASH splash10-00b9-5719000000-8489e3930001f5a7723e
Source of Spectrum E1-42-1435-12
Synonyms 2-(6-Methoxy-3-pyridinyl)-7-[(4-methylphenyl)sulfonyl]-7-azabicyclo[2.2.1]hept-2-ene Methyl 5-{7-[(4-methylphenyl)sulfonyl]-7-azabicyclo[2.2.1]hept-2-en-2-yl}-2-pyridinyl ether
Wiley ID 1552721