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Oxalate salt of 1-methyl-4-(3-nitrophenoxy)-1,2,3,6-tetrahydropyridine
SpectraBase Compound ID 4Ud7hWHAA7O
InChI InChI=1S/C12H14N2O3.C2H2O4/c1-13-7-5-11(6-8-13)17-12-4-2-3-10(9-12)14(15)16;3-1(4)2(5)6/h2-5,9H,6-8H2,1H3;(H,3,4)(H,5,6)
InChIKey VMOJVDZJJBLUTL-UHFFFAOYSA-N
Mol Weight 324.29 g/mol
Molecular Formula C14H16N2O7
Exact Mass 324.095751 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID H9xdDg6fc7O
Name Oxalate salt of 1-methyl-4-(3-nitrophenoxy)-1,2,3,6-tetrahydropyridine
Comments Less than 3 mono-isotopic peaks
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Formula C14H16N2O7
InChI InChI=1S/C12H14N2O3.C2H2O4/c1-13-7-5-11(6-8-13)17-12-4-2-3-10(9-12)14(15)16;3-1(4)2(5)6/h2-5,9H,6-8H2,1H3;(H,3,4)(H,5,6)
InChIKey VMOJVDZJJBLUTL-UHFFFAOYSA-N
Molecular Weight 324.289 g/mol
SMILES OC(C(=O)O)=O.c1(N(=O)=O)cc(OC2=CCN(C)CC2)ccc1
SPLASH splash10-0002-9000000000-d73804192709be61d893
Source of Spectrum E1-38-1907-14
Wiley ID 1598301