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2-[2-(4-Methoxyphenyl)-2-(benzotriazol-1-yl)ethyl]tetrahydro-2H-pyran isomer

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2-[2-(4-Methoxyphenyl)-2-(benzotriazol-1-yl)ethyl]tetrahydro-2H-pyran isomer
SpectraBase Compound ID 8TkhNa4v4gv
InChI InChI=1S/C20H23N3O2/c1-24-16-11-9-15(10-12-16)20(14-17-6-4-5-13-25-17)23-19-8-3-2-7-18(19)21-22-23/h2-3,7-12,17,20H,4-6,13-14H2,1H3
InChIKey NDMGOPQUWKGMLD-UHFFFAOYSA-N
Mol Weight 337.42 g/mol
Molecular Formula C20H23N3O2
Exact Mass 337.179027 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID FoJ5zxV3mdj
Name 2-[2-(4-Methoxyphenyl)-2-(benzotriazol-1-yl)ethyl]tetrahydro-2H-pyran isomer
Comments Computed using HOSE algorithm
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Exact Mass 337.179026991 u
Formula C20H23N3O2
InChI InChI=1S/C20H23N3O2/c1-24-16-11-9-15(10-12-16)20(14-17-6-4-5-13-25-17)23-19-8-3-2-7-18(19)21-22-23/h2-3,7-12,17,20H,4-6,13-14H2,1H3
InChIKey NDMGOPQUWKGMLD-UHFFFAOYSA-N
Molecular Weight 337.423 g/mol
SMILES C=12N=NN(C2=CC=CC1)C(CC1OCCCC1)C=1C=CC(=CC1)OC