| SpectraBase Compound ID | LZrrYw2vDsu |
|---|---|
| InChI | InChI=1S/C40H30N4/c1-2-3-12-32-39-30-19-10-8-17-28(30)37(43-39)22-35-26-15-6-4-13-24(26)33(41-35)21-34-25-14-5-7-16-27(25)36(42-34)23-38-29-18-9-11-20-31(29)40(32)44-38/h4-11,13-23,41,44H,2-3,12H2,1H3/b33-21-,34-21-,35-22-,36-23-,37-22-,38-23-,39-32-,40-32- |
| InChIKey | IPOGKLKXYCTTGQ-MRDZRMAJSA-N |
| Mol Weight | 566.7 g/mol |
| Molecular Formula | C40H30N4 |
| Exact Mass | 566.247047 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 2QwGVrYc08 |
|---|---|
| Name | 5-Butyltetrabenzoporphyrin |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C40H30N4 |
| InChI | InChI=1S/C40H30N4/c1-2-3-12-32-39-30-19-10-8-17-28(30)37(43-39)22-35-26-15-6-4-13-24(26)33(41-35)21-34-25-14-5-7-16-27(25)36(42-34)23-38-29-18-9-11-20-31(29)40(32)44-38/h4-11,13-23,41,44H,2-3,12H2,1H3/b33-21-,34-21-,35-22-,36-23-,37-22-,38-23-,39-32-,40-32- |
| InChIKey | IPOGKLKXYCTTGQ-MRDZRMAJSA-N |
| Molecular Weight | 566.708 g/mol |
| SMILES | [nH]1c-2cc-3nc(cc4[nH]c(c(c-5nc(cc1-c1c2cccc1)-c1c5cccc1)CCCC)c1c4cccc1)-c1c3cccc1 |
| SPLASH | splash10-02t9-0040090000-8dcd99ee39110370f074 |
| Source of Spectrum | O1-65-884-6 |
| Wiley ID | 1593099 |