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N-(Methoxycarbonyl)-2,3-benzo-5-(6'-chloro-3'-pyridyl)-7-azabicyclo[2.2.1]hept-2-ene
SpectraBase Compound ID BQXWkyvjwUO
InChI InChI=1S/C17H15ClN2O2/c1-22-17(21)20-14-8-13(10-6-7-15(18)19-9-10)16(20)12-5-3-2-4-11(12)14/h2-7,9,13-14,16H,8H2,1H3/t13-,14-,16-/m0/s1
InChIKey VMUHJDFKKFJTSW-DZKIICNBSA-N
Mol Weight 314.77 g/mol
Molecular Formula C17H15ClN2O2
Exact Mass 314.082205 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 6Ge8fmBOWO0
Name N-(Methoxycarbonyl)-2,3-benzo-5-(6'-chloro-3'-pyridyl)-7-azabicyclo[2.2.1]hept-2-ene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C17H15ClN2O2
InChI InChI=1S/C17H15ClN2O2/c1-22-17(21)20-14-8-13(10-6-7-15(18)19-9-10)16(20)12-5-3-2-4-11(12)14/h2-7,9,13-14,16H,8H2,1H3/t13-,14-,16-/m0/s1
InChIKey VMUHJDFKKFJTSW-DZKIICNBSA-N
Molecular Weight 314.772 g/mol
SMILES [C@]12(N([C@](c3ccccc23)(C[C@]1(c1cnc(cc1)Cl)[H])[H])C(=O)OC)[H]
SPLASH splash10-014i-0309000000-89eb8c49b3a30c6d9443
Source of Spectrum HE-1999-116-7
Wiley ID 1613435