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Ethyl 5-Oxo-6-azatricyclo[4.3.1(2,9).0]dec-3-ene-endo-10-carboxylate
SpectraBase Compound ID CchmsKZA4VX
InChI InChI=1S/C12H15NO3/c1-2-16-12(15)10-7-3-4-9(14)13-6-5-8(10)11(7)13/h3-4,7-8,10-11H,2,5-6H2,1H3/t7-,8+,10+,11-/m0/s1
InChIKey UZCMSLQTTMKSPC-URPMGSGRSA-N
Mol Weight 221.26 g/mol
Molecular Formula C12H15NO3
Exact Mass 221.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 4HI0HOVcV3O
Name Ethyl 5-Oxo-6-azatricyclo[4.3.1(2,9).0]dec-3-ene-endo-10-carboxylate
Comments Less than 3 mono-isotopic peaks
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Formula C12H15NO3
InChI InChI=1S/C12H15NO3/c1-2-16-12(15)10-7-3-4-9(14)13-6-5-8(10)11(7)13/h3-4,7-8,10-11H,2,5-6H2,1H3/t7-,8+,10+,11-/m0/s1
InChIKey UZCMSLQTTMKSPC-URPMGSGRSA-N
Molecular Weight 221.256 g/mol
SMILES [C@]12(N3C(=O)C=C[C@@]2([H])[C@]([C@]1(CC3)[H])(C(=O)OCC)[H])[H]
SPLASH splash10-0002-9030000000-ef19af6231ef8fb1ad9f
Source of Spectrum J-57-5711-14
Synonyms (1S,1aR,6aS,6bR)-4-Oxo-1a,2,3,4,6a,6b-hexahydro-1H-3a-aza-cyclobuta[cd]indene-1-carboxylic acid ethyl ester ethyl 5-oxo-6-azatricyclo[4.3.1.0(2,9)]dec-3-ene-10-carboxylate
Wiley ID 1221330