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5,14:7,12-Diepoxypentacene, 5,7,12,14-tetrahydro-6,13-dimethyl-5,7,12,14-tetraphenyl-
SpectraBase Compound ID JM4LwGR6QK3
InChI InChI=1S/C48H34O2/c1-31-41-43(47(35-23-11-5-12-24-35)39-29-17-15-27-37(39)45(41,49-47)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(44,50-46)36-25-13-6-14-26-36/h3-30H,1-2H3
InChIKey FSYWIKIRARGDLH-UHFFFAOYSA-N
Mol Weight 642.8 g/mol
Molecular Formula C48H34O2
Exact Mass 642.25588 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID K6VLOstO7OG
Name 5,14:7,12-Diepoxypentacene, 5,7,12,14-tetrahydro-6,13-dimethyl-5,7,12,14-tetraphenyl-
Alternate Name(s) 3,14-dimethyl-1,5,12,16-tetraphenyl-23,24-dioxaheptacyclo[14.6.1.1(5,12).0(2,15).0(4,13).0(6,11).0(17,22)]tetracosa-2(15),3,6,8,10,13,17,19,21-nonaene 6,11-Dimethyl-5,7,12,14-tetraphenyl-5,14:7,12-bisepoxy(di(pheno[a]cyclohexo)[4,5-a:4',5'-d]benzene)
CAS Registry Number 115695-55-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C48H34O2
InChI InChI=1S/C48H34O2/c1-31-41-43(47(35-23-11-5-12-24-35)39-29-17-15-27-37(39)45(41,49-47)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(44,50-46)36-25-13-6-14-26-36/h3-30H,1-2H3
InChIKey FSYWIKIRARGDLH-UHFFFAOYSA-N
Molecular Weight 642.798 g/mol
SMILES C12(c3c(c(C)c4C5(c6ccccc6C(c4c3C)(O5)c3ccccc3)c3ccccc3)C(O2)(c2ccccc2)c2c1cccc2)c1ccccc1
SPLASH splash10-0a59-0901711000-b4635f7ebec4f5b07775
Source of Spectrum F-43-5216-22
Wiley ID 1412776