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4-Oxooctahydrocinnoline-1,2-dicarboxylic acid, bis(2,2,2-trichloroethyl) ester
SpectraBase Compound ID 3coQC3jy94Y
InChI InChI=1S/C14H16Cl6N2O5/c15-13(16,17)6-26-11(24)21-5-10(23)8-3-1-2-4-9(8)22(21)12(25)27-7-14(18,19)20/h8-9H,1-7H2
InChIKey RNDDIFIJFQXITO-UHFFFAOYSA-N
Mol Weight 505.0 g/mol
Molecular Formula C14H16Cl6N2O5
Exact Mass 501.919038 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID LfyuiCmaXmR
Name 4-OXOOCTAHYDRO-CINNOLINE-1,2-DICARBOXYLIC ACID, BIS(2,2,2-TRICHLOROETHYL ESTER)
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Formula C14H16Cl6N2O5
InChI InChI=1S/C14H16Cl6N2O5/c15-13(16,17)6-26-11(24)21-5-10(23)8-3-1-2-4-9(8)22(21)12(25)27-7-14(18,19)20/h8-9H,1-7H2
InChIKey RNDDIFIJFQXITO-UHFFFAOYSA-N
Molecular Weight 501.9189
SMILES C12C(CN(C(OCC(Cl)(Cl)Cl)=O)N(C(OCC(Cl)(Cl)Cl)=O)C1CCCC2)=O
SPLASH splash10-001i-9310000000-ad3231083de607708bf4
Source of Spectrum Chemical Concepts, A Wiley Division, Weinheim, Germany