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Dibenzo[j,m]tetracyclo[7.2.2.0(2,8).0(3,7)]trideca-2(8),10,12-triene
SpectraBase Compound ID AvwK5AHl5qE
InChI InChI=1S/C21H18/c1-2-7-13-12(6-1)18-14-8-3-4-9-15(14)19(13)21-17-11-5-10-16(17)20(18)21/h1-4,6-9,16-19H,5,10-11H2/t16?,17?,18-,19+
InChIKey KYIXPUJXHHBFQM-YHFFBGSDSA-N
Mol Weight 270.37 g/mol
Molecular Formula C21H18
Exact Mass 270.140851 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FRtGNu5uSCm
Name Dibenzo[j,m]tetracyclo[7.2.2.0(2,8).0(3,7)]trideca-2(8),10,12-triene
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C21H18
InChI InChI=1S/C21H18/c1-2-7-13-12(6-1)18-14-8-3-4-9-15(14)19(13)21-17-11-5-10-16(17)20(18)21/h1-4,6-9,16-19H,5,10-11H2/t16?,17?,18-,19+
InChIKey KYIXPUJXHHBFQM-YHFFBGSDSA-N
Molecular Weight 270.375 g/mol
SMILES [C@]12(c3c(cccc3)[C@@](c3c1cccc3)(C1=C2C2C1CCC2)[H])[H]
SPLASH splash10-00b9-0690000000-9c447550c4ac07e35afd
Source of Spectrum K-119-1434-9
Synonyms (4r,9r)-2,3,3a,4,9,9b-hexahydro-1H-4,9-[1,2]benzenocyclopenta[3,4]cyclobuta[1,2-b]naphthalene
Wiley ID 1794479