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(5S*,9R*)-Methyl -9,10-dihydro-7-hydroxymethyl-2-methoxy-11-oxo-5,9-methanocycloocta[b]pyridine-5(6H)-carboxylate
SpectraBase Compound ID 2SxC3dd5HkR
InChI InChI=1S/C16H17NO5/c1-21-13-4-3-11-12(17-13)6-10-5-9(8-18)7-16(11,14(10)19)15(20)22-2/h3-5,10,18H,6-8H2,1-2H3/t10-,16-/m0/s1
InChIKey JOMKCGXRXNADNG-QFYYESIMSA-N
Mol Weight 303.31 g/mol
Molecular Formula C16H17NO5
Exact Mass 303.110673 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8NOmV08ty7w
Name (5S*,9R*)-Methyl -9,10-dihydro-7-hydroxymethyl-2-methoxy-11-oxo-5,9-methanocycloocta[b]pyridine-5(6H)-carboxylate
Alternate Name(s) Methyl (1S,9R)-11-(hydroxymethyl)-5-methoxy-13-oxo-6-azatricyclo[7.3.1.0(2,7)]trideca-2,4,6,10-tetraene-1-carboxylate
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Formula C16H17NO5
InChI InChI=1S/C16H17NO5/c1-21-13-4-3-11-12(17-13)6-10-5-9(8-18)7-16(11,14(10)19)15(20)22-2/h3-5,10,18H,6-8H2,1-2H3/t10-,16-/m0/s1
InChIKey JOMKCGXRXNADNG-QFYYESIMSA-N
Molecular Weight 303.314 g/mol
SMILES OCC1=C[C@@]2(C([C@](c3c(nc(cc3)OC)C2)(C(=O)OC)C1)=O)[H]
SPLASH splash10-0fxy-0492000000-073b08b1a5f8b97628e3
Source of Spectrum F-54-5500-38
Wiley ID 806792