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(1.alpha.,2.alpha.,3.alpha.,6.alpha.,7.alpha.,8.alpha.)-4,5-benzopentacyclo[6.6.2.2.2(3,6).0(2,7).0(9,14)]octadeca-4,9(14),11,15,17-pentaene

View entire compound with spectra: 1 MS (GC)

(1.alpha.,2.alpha.,3.alpha.,6.alpha.,7.alpha.,8.alpha.)-4,5-benzopentacyclo[6.6.2.2.2(3,6).0(2,7).0(9,14)]octadeca-4,9(14),11,15,17-pentaene
SpectraBase Compound ID wyVFL6TnTb
InChI InChI=1S/C22H20/c1-2-6-14-13(5-1)17-9-10-18(14)22-20-12-11-19(21(17)22)15-7-3-4-8-16(15)20/h1-6,9-12,17-22H,7-8H2/t17-,18+,19+,20-,21+,22-
InChIKey QERGJYFIQQEPLE-UHFFFAOYSA-N
Mol Weight 284.4 g/mol
Molecular Formula C22H20
Exact Mass 284.156501 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K8paRcwMRMc
Name (1.alpha.,2.alpha.,3.alpha.,6.alpha.,7.alpha.,8.alpha.)-4,5-benzopentacyclo[6.6.2.2.2(3,6).0(2,7).0(9,14)]octadeca-4,9(14),11,15,17-pentaene
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C22H20
InChI InChI=1S/C22H20/c1-2-6-14-13(5-1)17-9-10-18(14)22-20-12-11-19(21(17)22)15-7-3-4-8-16(15)20/h1-6,9-12,17-22H,7-8H2/t17-,18+,19+,20-,21+,22-
InChIKey QERGJYFIQQEPLE-UHFFFAOYSA-N
Molecular Weight 284.402 g/mol
SMILES [C@@]12([C@@]([C@@]3(C=C[C@]2(C2=C3CC=CC2)[H])[H])([C@]2(C=C[C@@]1(c1c2cccc1)[H])[H])[H])[H]
SPLASH splash10-001i-0390000000-c7672fef78671a487bf0
Source of Spectrum F-51-2922-26
Synonyms Hexacyclo[10.6.2.2(3,10).0(2,11).0(4,9).0(13,18)]docosa-4,6,8,13(18),15,19,21-heptaene
Wiley ID 791380