| SpectraBase Spectrum ID |
63tRvf4tvni |
| Name |
21H,23H-Porphine-2-propanoic acid, 8,13-diethyl-18-(1-fluoro-3-methoxy-3-oxo-1-propenyl)-3,7,12,17-tetramethyl-, methyl ester, (Z)- |
| CAS Registry Number |
121211-48-1 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C36H39FN4O4 |
| InChI |
InChI=1S/C36H39FN4O4/c1-9-22-18(3)26-14-27-20(5)24(11-12-34(42)44-7)32(40-27)17-33-36(25(37)13-35(43)45-8)21(6)29(41-33)16-31-23(10-2)19(4)28(39-31)15-30(22)38-26/h13-17,39-40H,9-12H2,1-8H3/b25-13-,26-14-,27-14-,28-15-,29-16-,30-15-,31-16-,32-17-,33-17- |
| InChIKey |
UZFAOLGHGBHCPE-KVWGSVTASA-N |
| Molecular Weight |
610.730 g/mol |
| SMILES |
[nH]1c2c(c(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4\C(=C\C(=O)OC)F)C)c(c3C)CCC(=O)OC)c(c1CC)C)C)CC |
| SPLASH |
splash10-03di-0000029000-a974d8a4054270302bdc |
| Source of Spectrum |
J-54-3278-31 |
| Synonyms |
2,4-Diethyl-6-[1-fluoro-2-(methoxycarbonyl)ethenyl]-7-[2-(methoxycarbonyl)ethyl]-1,3,5,8-tetramethylporphyrin
Methyl (2Z)-3-[9,14-diethyl-20-(3-methoxy-3-oxopropyl)-5,10,15,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1(20),2,4,6(24),7,9,11,13(22),14,16,18-undecaen-4-yl]-3-fluoro-2-propenoate |
| Wiley ID |
1410926 |
