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5,18:9,14-Di[1',2']benzeno-5,9,14,18-tetrahydronaphtho[2,3-c]pentaphene-6,15-dione
SpectraBase Compound ID 8b0R5ppTJJz
InChI InChI=1S/C42H26/c1-5-13-29-25(9-1)37-26-10-2-6-14-30(26)39(29)41-33(37)19-17-23-22-36-24(21-35(23)41)18-20-34-38-27-11-3-7-15-31(27)40(42(34)36)32-16-8-4-12-28(32)38/h1-22,37-40H/t37-,38-,39+,40+
InChIKey UOATZQFGKPECNO-HRGSHGMJSA-N
Mol Weight 530.7 g/mol
Molecular Formula C42H26
Exact Mass 530.203451 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID GnpeHb7VCST
Name 5,18:9,14-Di[1',2']benzeno-5,9,14,18-tetrahydronaphtho[2,3-c]pentaphene-6,15-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H26
InChI InChI=1S/C42H26/c1-5-13-29-25(9-1)37-26-10-2-6-14-30(26)39(29)41-33(37)19-17-23-22-36-24(21-35(23)41)18-20-34-38-27-11-3-7-15-31(27)40(42(34)36)32-16-8-4-12-28(32)38/h1-22,37-40H/t37-,38-,39+,40+
InChIKey UOATZQFGKPECNO-HRGSHGMJSA-N
Molecular Weight 530.670 g/mol
SMILES c12[C@]3(c4ccccc4[C@@](c2ccc2cc4c5[C@]6(c7ccccc7[C@@](c5ccc4cc12)(c1ccccc61)[H])[H])(c1ccccc31)[H])[H]
SPLASH splash10-000i-9310000000-27e8ca4d9db236396259
Source of Spectrum J-56-6915-11
Synonyms undecacyclo[22.6.6.6(9,16).0(2,23).0(3,20).0(5,18).0(8,17).0(10,15).0(25,30).0(31,36).0(37,42)]dotetraconta-2,4,6,8(17),10,12,14,18,20,22,25,27,29,31,33,35,37,39,41-nonadecaene
Wiley ID 1403431