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 |