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9,18-Dioxatricyclo[18.4.0.0(2,7)]tetracosa-1(20),2(7),3,5,13,21,23-heptaene-11,15-diyne-8,19-dione
SpectraBase Compound ID eMUylkCLwv
InChI InChI=1S/C22H14O4/c23-21-19-13-7-5-11-17(19)18-12-6-8-14-20(18)22(24)26-16-10-4-2-1-3-9-15-25-21/h1-2,5-8,11-14H,15-16H2/b2-1-
InChIKey ZTOQBUNXDQUXJJ-UPHRSURJSA-N
Mol Weight 342.35 g/mol
Molecular Formula C22H14O4
Exact Mass 342.089209 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID DZ0Ay8DgMRG
Name 9,18-Dioxatricyclo[18.4.0.0(2,7)]tetracosa-1(20),2(7),3,5,13,21,23-heptaene-11,15-diyne-8,19-dione
Comments Less than 3 mono-isotopic peaks
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Formula C22H14O4
InChI InChI=1S/C22H14O4/c23-21-19-13-7-5-11-17(19)18-12-6-8-14-20(18)22(24)26-16-10-4-2-1-3-9-15-25-21/h1-2,5-8,11-14H,15-16H2/b2-1-
InChIKey ZTOQBUNXDQUXJJ-UPHRSURJSA-N
Molecular Weight 342.350 g/mol
SMILES c12-c3c(C(OCC#C\C=C/C#CCOC(c2cccc1)=O)=O)cccc3
SPLASH splash10-004i-0091000000-a2f96054e453aafefc91
Source of Spectrum J-61-4260-5
Synonyms 12,13,16,17-tetradehydro-11,18-dihydrodibenzo[c,e][1,8]dioxacyclohexadecin-9,20-dione
Wiley ID 1336876