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1-Methyl-4-(.alpha.-naphthoxy)-1,2,3,6-tetrahydropyridine oxolate

View entire compound with spectra: 1 NMR, and 1 MS (GC)

1-Methyl-4-(.alpha.-naphthoxy)-1,2,3,6-tetrahydropyridine oxolate
SpectraBase Compound ID Ccj1BrAUNm4
InChI InChI=1S/C16H17NO.C2H2O4/c1-17-11-9-14(10-12-17)18-16-8-4-6-13-5-2-3-7-15(13)16;3-1(4)2(5)6/h2-9H,10-12H2,1H3;(H,3,4)(H,5,6)
InChIKey CDPIDEHFRRTSOP-UHFFFAOYSA-N
Mol Weight 329.35 g/mol
Molecular Formula C18H19NO5
Exact Mass 329.126323 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 3TtHj5XgJFc
Name 1-Methyl-4-(.alpha.-naphthoxy)-1,2,3,6-tetrahydropyridine oxolate
Comments Computed using HOSE algorithm
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Exact Mass 329.126322711 u
Formula C18H19NO5
InChI InChI=1S/C16H17NO.C2H2O4/c1-17-11-9-14(10-12-17)18-16-8-4-6-13-5-2-3-7-15(13)16;3-1(4)2(5)6/h2-9H,10-12H2,1H3;(H,3,4)(H,5,6)
InChIKey CDPIDEHFRRTSOP-UHFFFAOYSA-N
Molecular Weight 329.352 g/mol
SMILES C=1(OC2=CCN(CC2)C)C=2C(=CC=CC2)C=CC1.C(C(=O)O)(=O)O