For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
6,9-Dioctyltribenzo[fg,ij,rst]pentaphene
SpectraBase Compound ID 4yBbf74zzTo
InChI InChI=1S/C46H48/c1-3-5-7-9-11-13-19-31-27-39-35-23-17-15-21-33(35)37-25-26-38-34-22-16-18-24-36(34)40-28-32(20-14-12-10-8-6-4-2)30-42-41(29-31)43(39)45(37)46(38)44(40)42/h15-18,21-30H,3-14,19-20H2,1-2H3
InChIKey VACSRBNPBQRTKI-UHFFFAOYSA-N
Mol Weight 600.9 g/mol
Molecular Formula C46H48
Exact Mass 600.375602 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID E5tr1EHX37Y
Name 6,9-Dioctyltribenzo[fg,ij,rst]pentaphene
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C46H48
InChI InChI=1S/C46H48/c1-3-5-7-9-11-13-19-31-27-39-35-23-17-15-21-33(35)37-25-26-38-34-22-16-18-24-36(34)40-28-32(20-14-12-10-8-6-4-2)30-42-41(29-31)43(39)45(37)46(38)44(40)42/h15-18,21-30H,3-14,19-20H2,1-2H3
InChIKey VACSRBNPBQRTKI-UHFFFAOYSA-N
Molecular Weight 600.890 g/mol
SMILES c12c3c4c5cc(cc4c4c2c(cc(CCCCCCCC)c4)c2c(c1ccc3c1c5cccc1)cccc2)CCCCCCCC
SPLASH splash10-0udi-0000009000-95295212ebb5888e2feb
Source of Spectrum F4-44-1931-1a
Wiley ID 1707335