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10,15[1',2']Benzebebenzo[5,6]cycloocta[1,2-L]phenthrene, 8A,9,10,15,16,16A-hexahydro-9,16-diphenyl-,
SpectraBase Compound ID 6Gsvjhn0Vu9
InChI InChI=1S/C42H32/c1-3-15-27(16-4-1)37-39-33-23-11-13-25-35(33)40(36-26-14-12-24-34(36)39)38(28-17-5-2-6-18-28)42-32-22-10-8-20-30(32)29-19-7-9-21-31(29)41(37)42/h1-26,37-42H/t37-,38?,39-,40?,41-,42+/m1/s1
InChIKey PCKLFALYYQPZGF-UHFFFAOYSA-N
Mol Weight 536.7 g/mol
Molecular Formula C42H32
Exact Mass 536.250401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID AU47uMoBTDF
Name 10,15[1',2']benzebebenzo[5,6]cycloocta[1,2-l]phenthrene, 8a,9,10,15,16,16a-hexahydro-9,16-diphenyl-,
CAS Registry Number 137594-02-6
Copyright Copyright © 2020-2025 John Wiley & Sons, Inc. All Rights Reserved.
Formula C42H32
InChI InChI=1S/C42H32/c1-3-15-27(16-4-1)37-39-33-23-11-13-25-35(33)40(36-26-14-12-24-34(36)39)38(28-17-5-2-6-18-28)42-32-22-10-8-20-30(32)29-19-7-9-21-31(29)41(37)42/h1-26,37-42H/t37-,38?,39-,40?,41-,42+/m1/s1
InChIKey PCKLFALYYQPZGF-UHFFFAOYSA-N
Molecular Weight 536.718 g/mol
SMILES C12C([C@]3([C@](c4ccccc4-c4c3cccc4)([C@@](C(c3c2cccc3)c2c1cccc2)(c1ccccc1)[H])[H])[H])c1ccccc1
SPLASH splash10-014l-6490000000-f5370c24bb25e3a4694a
Source of Spectrum C-114-698-11
Synonyms 2,17-diphenylheptacyclo[16.6.6.0(3,16).0(4,9).0(10,15).0(19,24).0(25,30)]triaconta-4,6,8,10,12,14,19,21,23,25,27,29-dodecaene
Wiley ID 1404187