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3H,3'H,3''H-Trisindeno[1,2-a:2',1'-c:1'',2''-e]benzene
SpectraBase Compound ID 2MgnfiYmRXz
InChI InChI=1S/C27H18/c1-4-10-19-16(7-1)13-22-23-14-17-8-2-5-11-20(17)26(23)27-21-12-6-3-9-18(21)15-24(27)25(19)22/h1-12H,13-15H2
InChIKey VGRJHHLDEYYRNF-UHFFFAOYSA-N
Mol Weight 342.44 g/mol
Molecular Formula C27H18
Exact Mass 342.140851 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID jwVN8pWwHJ
Name 3H,3'H,3''H-Trisindeno[1,2-A:2',1'-C:1'',2''-E]benzene
Comments Computed using HOSE algorithm
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Exact Mass 342.140850580 u
Formula C27H18
InChI InChI=1S/C27H18/c1-4-10-19-16(7-1)13-22-23-14-17-8-2-5-11-20(17)26(23)27-21-12-6-3-9-18(21)15-24(27)25(19)22/h1-12H,13-15H2
InChIKey VGRJHHLDEYYRNF-UHFFFAOYSA-N
Molecular Weight 342.441 g/mol
SMILES C1=C2CC3=C4C(C=5C(=CC=CC5)C4)=C4C(=C3C2=CC=C1)C1=CC=CC=C1C4