| SpectraBase Spectrum ID |
1wAhZSsxxjZ |
| Name |
21H,23H-Porphine-2,18-dipropanoic acid, 7,12-bis(2-fluoroethyl)-3,8,13,17-tetramethyl-, dimethyl ester |
| CAS Registry Number |
121211-51-6 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C36H40F2N4O4 |
| InChI |
InChI=1S/C36H40F2N4O4/c1-19-23(7-9-35(43)45-5)33-18-34-24(8-10-36(44)46-6)20(2)29(42-34)16-32-26(12-14-38)22(4)30(41-32)17-31-25(11-13-37)21(3)28(39-31)15-27(19)40-33/h15-18,39,42H,7-14H2,1-6H3/b27-15-,28-15-,29-16-,30-17-,31-17-,32-16-,33-18-,34-18- |
| InChIKey |
NDMAZMCDTRBRLP-SHWYJLMRSA-N |
| Molecular Weight |
630.737 g/mol |
| SMILES |
[nH]1c2c(c(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4CCC(=O)OC)C)c(c3C)CCC(=O)OC)c(c1C)CCF)CCF)C |
| SPLASH |
splash10-001i-0000019000-1b267e159250b3f60a35 |
| Source of Spectrum |
J-54-3279-37 |
| Synonyms |
2,4-bis(2-fluoroethyl)-6,7-bis[2-(methoxycarbonyl)ethyl]-1,3,5,8-tetramethylporphyrin
Methyl 3-[10,15-bis(2-fluoroethyl)-20-(3-methoxy-3-oxopropyl)-5,9,14,19-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]propanoate |
| Wiley ID |
1412104 |
