| SpectraBase Spectrum ID |
B8Oqq7SuOQp |
| Name |
3-(3-CYANOMETHYL-7,8,12,13,17,18-HEXAETHYL-22,24-DIHYDROPORPHIN-2-YL)ACRYLONITRILE |
| Copyright |
Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved. |
| Formula |
C37H40N6 |
| InChI |
InChI=1S/C37H40N6/c1-7-22-23(8-2)31-19-33-25(10-4)27(12-6)35(42-33)21-37-29(15-17-39)28(14-13-16-38)36(43-37)20-34-26(11-5)24(9-3)32(41-34)18-30(22)40-31/h13-14,18-21,41-42H,7-12,15H2,1-6H3/b14-13+,30-18-,31-19-,32-18-,33-19-,34-20-,35-21-,36-20-,37-21- |
| InChIKey |
JUUDJWNSAFLCAI-QONKUQLYSA-N |
| Molecular Weight |
568.3306 |
| SMILES |
[nH]1c2cc3c(c(c(cc4c(c(c(cc5nc(cc1c(c2CC)CC)c(c5\C=C\C#N)CC#N)[nH]4)CC)CC)n3)CC)CC |
| SPLASH |
splash10-014i-0130190000-62a94aae966c0a9fd0f1 |
| Source of Spectrum |
Chemical Concepts, A Wiley Division, Weinheim, Germany |
