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14,17-Dichloro-15,16-didehydro-1,6-methano[24]annulene-13,18-dione
SpectraBase Compound ID 2ZwXPCYidm2
InChI InChI=1S/C25H18Cl2O2/c26-22-17-18-23(27)25(29)16-8-4-2-6-12-21-14-10-9-13-20(19-21)11-5-1-3-7-15-24(22)28/h1-16H,19H2/b3-1+,4-2+,11-5+,12-6+,15-7+,16-8+,23-22-
InChIKey GPINGUGTFXSOBE-OBHXKDQPSA-N
Mol Weight 421.32 g/mol
Molecular Formula C25H18Cl2O2
Exact Mass 420.068385 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID KB2lE6UmO4x
Name 14,17-Dichloro-15,16-didehydro-1,6-methano[24]annulene-13,18-dione
Alternate Name(s) 9,12-dichlorobicyclo[18.4.1]pentacosa-1(24),2,4,6,9,10,11,14,16,18,20,22-dodecaene-8,13-dione
Comments Less than 3 mono-isotopic peaks
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Formula C25H18Cl2O2
InChI InChI=1S/C25H18Cl2O2/c26-22-17-18-23(27)25(29)16-8-4-2-6-12-21-14-10-9-13-20(19-21)11-5-1-3-7-15-24(22)28/h1-16H,19H2/b3-1+,4-2+,11-5+,12-6+,15-7+,16-8+,23-22-
InChIKey GPINGUGTFXSOBE-OBHXKDQPSA-N
Molecular Weight 421.323 g/mol
SMILES \C1(=C=C=C/(C(\C=C\C=C\C=C\C2=CC=CC=C(\C=C\C=C\C=C\C1=O)C2)=O)Cl)Cl
SPLASH splash10-001i-9000000000-2e5281d5b2bb1edf76fd
Source of Spectrum KC-0-1466-5
Wiley ID 781315