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(1R,9R,12S)-5-Methoxy-8-oxo-11-azatricyclo[7.3.1.0(2.7)]trideca-2(7),3,5-triene-11,12-dicarboxylic acid dimethyl ester
SpectraBase Compound ID yw5zbORTk5
InChI InChI=1S/C17H19NO6/c1-22-10-4-5-11-12-6-9(15(19)13(11)7-10)8-18(17(21)24-3)14(12)16(20)23-2/h4-5,7,9,12,14H,6,8H2,1-3H3/t9-,12+,14+/m1/s1
InChIKey HQWWZMAXUCOMOI-LQJRIPTKSA-N
Mol Weight 333.34 g/mol
Molecular Formula C17H19NO6
Exact Mass 333.121237 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 7GbJXZOmvCt
Name (1R,9R,12S)-5-Methoxy-8-oxo-11-azatricyclo[7.3.1.0(2.7)]trideca-2(7),3,5-triene-11,12-dicarboxylic acid dimethyl ester
Alternate Name(s) Dimethyl (1R,9R)-5-methoxy-8-oxo-11-azatricyclo[7.3.1.0(2,7)]trideca-2,4,6-triene-11,12-dicarboxylate
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Formula C17H19NO6
InChI InChI=1S/C17H19NO6/c1-22-10-4-5-11-12-6-9(15(19)13(11)7-10)8-18(17(21)24-3)14(12)16(20)23-2/h4-5,7,9,12,14H,6,8H2,1-3H3/t9-,12+,14+/m1/s1
InChIKey HQWWZMAXUCOMOI-LQJRIPTKSA-N
Molecular Weight 333.340 g/mol
SMILES [C@]1(N(C[C@@]2(C(c3cc(ccc3[C@@]1(C2)[H])OC)=O)[H])C(=O)OC)(C(=O)OC)[H]
SPLASH splash10-00di-3090000000-2830031dc7447d34f370
Source of Spectrum F-68-6684-14
Wiley ID 1573314