| SpectraBase Spectrum ID |
7amKDlX2kFt |
| Name |
Copper tetraphenylporphyrin |
| CAS Registry Number |
14172-91-9 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C44H28CuN4 |
| InChI |
InChI=1S/C44H28N4.Cu/c1-5-13-29(14-6-1)41-33-21-23-35(45-33)42(30-15-7-2-8-16-30)37-25-27-39(47-37)44(32-19-11-4-12-20-32)40-28-26-38(48-40)43(31-17-9-3-10-18-31)36-24-22-34(41)46-36;/h1-28H;/q-2;+2/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-; |
| InChIKey |
RKTYLMNFRDHKIL-DAJBKUBHSA-N |
| Molecular Weight |
676.282 g/mol |
| SMILES |
C1=2[N-]=3[Cu+2]45N6C(=C(C3C=C1)c1ccccc1)C=CC6=C(c1ccccc1)C1=[N-]4C(C=C1)=C(c1[n]5c(C2c2ccccc2)cc1)c1ccccc1 |
| SPLASH |
splash10-004i-0000009000-014b4fd67a6ab3f7ddd0 |
| Source of Spectrum |
KC-0-1259-20 |
| Wiley ID |
785757 |
