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Methyl 9-hydroxy-2-oxo-1-azatricyclo[7.3.0.0(3,8)]dodeca-3,4,6-trien-10-carboxylate
SpectraBase Compound ID J4ptYNBnwY8
InChI InChI=1S/C13H13NO4/c1-18-12(16)10-6-7-14-11(15)8-4-2-3-5-9(8)13(10,14)17/h2-5,10,17H,6-7H2,1H3/t10-,13-/m1/s1
InChIKey NKQLQMPVKUHRTQ-ZWNOBZJWSA-N
Mol Weight 247.25 g/mol
Molecular Formula C13H13NO4
Exact Mass 247.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GdW9A9pMJ5b
Name Methyl 9-hydroxy-2-oxo-1-azatricyclo[7.3.0.0(3,8)]dodeca-3,4,6-trien-10-carboxylate
Alternate Name(s) (9S,10R) Methyl 9-hydroxy-2-oxo-1-azatricyclo[7.3.0.0(3,8)]dodeca-3,4,6-trien-10-carboxylate Methyl 9b-hydroxy-5-oxo-1H,2H,3H,5H,9aH,9bH-cyclohexa[a]pyrrolizine-1-carboxylate
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Formula C13H13NO4
InChI InChI=1S/C13H13NO4/c1-18-12(16)10-6-7-14-11(15)8-4-2-3-5-9(8)13(10,14)17/h2-5,10,17H,6-7H2,1H3/t10-,13-/m1/s1
InChIKey NKQLQMPVKUHRTQ-ZWNOBZJWSA-N
Molecular Weight 247.250 g/mol
SMILES O[C@@]12N(C(=O)c3c2cccc3)CC[C@@]1(C(=O)OC)[H]
SPLASH splash10-03dr-0920000000-413f40df00cb9dd5250e
Source of Spectrum C-117-2707-38
Wiley ID 758734