| SpectraBase Spectrum ID |
5hyTI2bAYNC |
| Name |
3-(7,8,12,13,17,18-Hexaethyl-3-methyl-22,24-dihydro-porphin-2-yl)-propionitrile |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C36H43N5 |
| InChI |
InChI=1S/C36H43N5/c1-8-22-23(9-2)31-18-32-24(10-3)25(11-4)33(40-32)19-34-26(12-5)27(13-6)35(41-34)20-36-28(15-14-16-37)21(7)29(38-36)17-30(22)39-31/h17-20,39,41H,8-15H2,1-7H3/b29-17-,30-17-,31-18-,32-18-,33-19-,34-19-,35-20-,36-20- |
| InChIKey |
UXMUAWZODCCKIB-PUQSVQPZSA-N |
| Molecular Weight |
545.775 g/mol |
| SMILES |
[nH]1c2c(c(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4CCC#N)C)c(c3CC)CC)c(c1CC)CC)CC)CC |
| SPLASH |
splash10-0002-2141390000-8f95f05863e294e339de |
| Source of Spectrum |
CM-1999-19062-0 |
| Wiley ID |
481416 |
