| SpectraBase Spectrum ID |
KiGXry7uvuk |
| Name |
21H,23H-Porphine-2-propanoic acid, 8,13-diethyl-18-(fluoromethyl)-3,7,12,17-tetramethyl-, methyl ester |
| CAS Registry Number |
121211-46-9 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C33H37FN4O2 |
| InChI |
InChI=1S/C33H37FN4O2/c1-8-21-17(3)25-12-26-19(5)23(10-11-33(39)40-7)31(37-26)15-32-24(16-34)20(6)28(38-32)14-30-22(9-2)18(4)27(36-30)13-29(21)35-25/h12-15,36-37H,8-11,16H2,1-7H3/b25-12-,26-12-,27-13-,28-14-,29-13-,30-14-,31-15-,32-15- |
| InChIKey |
WZTKOZVJMACEMX-LIBAJKRWSA-N |
| Molecular Weight |
540.683 g/mol |
| SMILES |
[nH]1c2c(c(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4C)CF)c(c3C)CC)c(c1C)CC)C)CCC(=O)OC |
| SPLASH |
splash10-00di-0000190000-abe4a95b6ce979bc6372 |
| Source of Spectrum |
J-54-3278-25 |
| Synonyms |
2,4-Diethyl-6-(fluoromethyl)-7-[2-(methoxycarbonyl)-ethyl]-1,3,5,8-tetramethylporphyrin
Methyl 3-[10,15-diethyl-20-(fluoromethyl)-5,9,14,19-tetramethyl-21,22,23,24-tetraazapentacyclo[16.2.1.1(3,6).1(8,11).1(13,16)]tetracosa-1(21),2,4,6,8(23),9,11,13,15,17,19-undecaen-4-yl]propanoate |
| Wiley ID |
1404678 |
