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Pentacene, 6,13-dihydro-6,13-bis(methylene)-5,7,12,14-tetraphenyl-
SpectraBase Compound ID 6FV8bDkHaZ1
InChI InChI=1S/C48H32/c1-31-41-43(47(35-23-11-5-12-24-35)39-29-17-15-27-37(39)45(41)33-19-7-3-8-20-33)32(2)44-42(31)46(34-21-9-4-10-22-34)38-28-16-18-30-40(38)48(44)36-25-13-6-14-26-36/h3-30H,1-2H2
InChIKey QWQUWJWLMKRLFP-UHFFFAOYSA-N
Mol Weight 608.8 g/mol
Molecular Formula C48H32
Exact Mass 608.250401 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FbWiUXEVPJT
Name Pentacene, 6,13-dihydro-6,13-bis(methylene)-5,7,12,14-tetraphenyl-
CAS Registry Number 115695-60-8
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H32
InChI InChI=1S/C48H32/c1-31-41-43(47(35-23-11-5-12-24-35)39-29-17-15-27-37(39)45(41)33-19-7-3-8-20-33)32(2)44-42(31)46(34-21-9-4-10-22-34)38-28-16-18-30-40(38)48(44)36-25-13-6-14-26-36/h3-30H,1-2H2
InChIKey QWQUWJWLMKRLFP-UHFFFAOYSA-N
Molecular Weight 608.784 g/mol
SMILES C1(c2c(c(-c3ccccc3)c3c(c2-c2ccccc2)cccc3)C(c2c1c(c1c(cccc1)c2-c1ccccc1)-c1ccccc1)=C)=C
SPLASH splash10-0a4l-7090007000-d3710c3e6d0248cbbc8d
Source of Spectrum F-43-5216-29
Synonyms 5,7,12,14-Tetraphenyl-6,13-bis-methylene-6,13-dihydropentacene 6,13-dimethylene-5,7,12,14-tetraphenyl-6,13-dihydropentacene
Wiley ID 1410807