| SpectraBase Compound ID | DxUU1yHCRiO |
|---|---|
| InChI | InChI=1S/C38H50N4O/c1-10-23-24(11-2)31-19-33-27(14-5)28(15-6)35(41-33)21-37-38(22(9)43-17-8)29(16-7)36(42-37)20-34-26(13-4)25(12-3)32(40-34)18-30(23)39-31/h18-22,40-41H,10-17H2,1-9H3/b30-18-,31-19-,32-18-,33-19-,34-20-,35-21-,36-20-,37-21- |
| InChIKey | FHCGLTWFBPDBPS-ARUWFBQFSA-N |
| Mol Weight | 578.8 g/mol |
| Molecular Formula | C38H50N4O |
| Exact Mass | 578.398462 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | JdpljjR1HEt |
|---|---|
| Name | 1-(1-Ethoxyethyl)-2,3,4,5,6,7,8-heptaethylporphyrin |
| Alternate Name(s) | 10-(1-ethoxyethyl)-4,5,9,14,15,19,20-heptaethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaene ethyl 1-[5,9,10,14,15,19,20-heptaethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1,3(24),4,6,8,10,12,14,16(22),17,19-undecaen-4-yl]ethyl ether |
| Comments | Less than 3 mono-isotopic peaks |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C38H50N4O |
| InChI | InChI=1S/C38H50N4O/c1-10-23-24(11-2)31-19-33-27(14-5)28(15-6)35(41-33)21-37-38(22(9)43-17-8)29(16-7)36(42-37)20-34-26(13-4)25(12-3)32(40-34)18-30(23)39-31/h18-22,40-41H,10-17H2,1-9H3/b30-18-,31-19-,32-18-,33-19-,34-20-,35-21-,36-20-,37-21- |
| InChIKey | FHCGLTWFBPDBPS-ARUWFBQFSA-N |
| Molecular Weight | 578.845 g/mol |
| SMILES | [nH]1c2c(c(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4CC)C(OCC)C)c(c3CC)CC)c(c1CC)CC)CC)CC |
| SPLASH | splash10-002r-0000090000-34ce1df6debcaac00902 |
| Source of Spectrum | F-47-6891-5 |
| Wiley ID | 1408395 |