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cis-5,5-Diethoxycarbonyl-3a,4-dihydro-6-(4-methylphenyl)-3H,6H-cyclopenta[3.4-c]isoxazole
SpectraBase Compound ID 4t0gmE6zXCL
InChI InChI=1S/C19H23NO5/c1-4-23-17(21)19(18(22)24-5-2)10-14-11-25-20-16(14)15(19)13-8-6-12(3)7-9-13/h6-9,14-15H,4-5,10-11H2,1-3H3/t14-,15+/m0/s1
InChIKey KDCYEVPBZVAMFP-LSDHHAIUSA-N
Mol Weight 345.4 g/mol
Molecular Formula C19H23NO5
Exact Mass 345.157623 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID ISn963747c0
Name cis-5,5-Diethoxycarbonyl-3a,4-dihydro-6-(4-methylphenyl)-3H,6H-cyclopenta[3.4-c]isoxazole
Alternate Name(s) (3aR,6S)-6-p-Tolyl-3a,4-dihydro-3H,6H-cyclopenta[c]isoxazole-5,5-dicarboxylic acid diethyl ester Diethyl (3aR,6S)-6-(4-methylphenyl)-3a,4-dihydro-3H-cyclopenta[c]isoxazole-5,5(6H)-dicarboxylate
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Formula C19H23NO5
InChI InChI=1S/C19H23NO5/c1-4-23-17(21)19(18(22)24-5-2)10-14-11-25-20-16(14)15(19)13-8-6-12(3)7-9-13/h6-9,14-15H,4-5,10-11H2,1-3H3/t14-,15+/m0/s1
InChIKey KDCYEVPBZVAMFP-LSDHHAIUSA-N
Molecular Weight 345.395 g/mol
SMILES C1([C@@](C2=NOC[C@@]2(C1)[H])(c1ccc(cc1)C)[H])(C(=O)OCC)C(=O)OCC
SPLASH splash10-00dj-1096000000-d5e2e6167bca6752da99
Source of Spectrum F-54-14006-5
Wiley ID 809756