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Tetracyclo[7.3.0.0(3,8).0(1,3)]dodecan-10-one, 2-.alpha.-carboethoxy-2-.beta.-cyano-, (cis,syn,cis)
SpectraBase Compound ID Bdujo7GQZml
InChI InChI=1S/C16H19NO3/c1-2-20-13(19)16(9-17)14-7-4-3-5-10(14)12-11(18)6-8-15(12,14)16/h10,12H,2-8H2,1H3
InChIKey MQSIWYPPEPPKMY-UHFFFAOYSA-N
Mol Weight 273.33 g/mol
Molecular Formula C16H19NO3
Exact Mass 273.136493 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GVPC2gwEIJI
Name Tetracyclo[7.3.0.0(3,8).0(1,3)]dodecan-10-one, 2-.alpha.-carboethoxy-2-.beta.-cyano-, (cis,syn,cis)
Alternate Name(s) Ethyl 1-cyano-4-oxooctahydro-2H-cyclopenta[3,4]cyclopropa[2,3]cyclobuta[1,2-a]benzene-1-carboxylate
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Formula C16H19NO3
InChI InChI=1S/C16H19NO3/c1-2-20-13(19)16(9-17)14-7-4-3-5-10(14)12-11(18)6-8-15(12,14)16/h10,12H,2-8H2,1H3
InChIKey MQSIWYPPEPPKMY-UHFFFAOYSA-N
Molecular Weight 273.332 g/mol
SMILES C1(=O)CCC23C4(C(CCCC4)C12)C3(C#N)C(=O)OCC
SPLASH splash10-0pdi-5920000000-d883727a0593545744f4
Wiley ID 1494455