| SpectraBase Spectrum ID |
1rRVbZjFFVB |
| Name |
2,3,7,8,12,13,17,18-Octaethyl-5-(1,4-dimethylphen-6-yl)porphyrin |
| Alternate Name(s) |
2,3,7,8,12,13,17,18-Octaethyl-5-(1,4-dimethoxylphen-6-yl)porphyrin |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C44H54N4O2 |
| InChI |
InChI=1S/C44H54N4O2/c1-11-26-28(13-3)37-23-39-30(15-5)32(17-7)43(47-39)42(34-21-25(49-9)19-20-41(34)50-10)44-33(18-8)31(16-6)40(48-44)24-38-29(14-4)27(12-2)36(46-38)22-35(26)45-37/h19-24,45,48H,11-18H2,1-10H3/b35-22-,36-22-,37-23-,38-24-,39-23-,40-24-,43-42-,44-42- |
| InChIKey |
LCLYGZIVVCTVPN-ZDHSBLQKSA-N |
| Molecular Weight |
670.942 g/mol |
| SMILES |
[nH]1c2c(c(c1cc1nc(cc3[nH]c(cc4nc(c2-c2c(ccc(c2)OC)OC)c(c4CC)CC)c(c3CC)CC)c(c1CC)CC)CC)CC |
| SPLASH |
splash10-00di-0001009000-5a45c1c138114b4a5b37 |
| Source of Spectrum |
QE-6-2732-3 |
| Wiley ID |
844877 |
