SpectraBase Spectrum ID |
J3DNTajPgx4 |
Name |
(E)-12c-[4-(Phenyldiazenyl)phenyl]ethynyl-4,8,12-tri-n-propyl-4,8,12-triazatriangulene |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C42H39N5 |
InChI |
InChI=1S/C42H39N5/c1-4-27-45-33-15-10-17-35-39(33)42(26-25-30-21-23-32(24-22-30)44-43-31-13-8-7-9-14-31)40-34(45)16-11-18-36(40)47(29-6-3)38-20-12-19-37(41(38)42)46(35)28-5-2/h7-24H,4-6,27-29H2,1-3H3/b44-43+ |
InChIKey |
UGWBTMWMIHGQDJ-VGFSZAGXSA-N |
Molecular Weight |
613.809 g/mol |
SMILES |
C12(c3c4cccc3N(c3c1c(N(CCC)c1c2c(N4CCC)ccc1)ccc3)CCC)C#Cc1ccc(\N=N\c2ccccc2)cc1 |
SPLASH |
splash10-0pvi-0988401000-0fb4ddb1db7a077c69e0 |
Source of Spectrum |
U1-2010-5050-6a |
Wiley ID |
1664320 |