| SpectraBase Spectrum ID |
C6RN5bVwDPS |
| Name |
5,15-Bis(3-methoxyphenyl)-10-pentyl-20-phenylporphyrin |
| Alternate Name(s) |
2,12-bis(3-methoxyphenyl)-17-pentyl-7-phenyl-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 |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C45H40N4O2 |
| InChI |
InChI=1S/C45H40N4O2/c1-4-5-7-18-34-35-19-21-39(46-35)44(30-14-10-16-32(27-30)50-2)41-25-23-37(48-41)43(29-12-8-6-9-13-29)38-24-26-42(49-38)45(40-22-20-36(34)47-40)31-15-11-17-33(28-31)51-3/h6,8-17,19-28,46,49H,4-5,7,18H2,1-3H3/b35-34-,36-34-,43-37-,43-38-,44-39-,44-41-,45-40-,45-42- |
| InChIKey |
KEZRYWNUMMRVGU-YNHAILHXSA-N |
| Molecular Weight |
668.841 g/mol |
| SMILES |
[nH]1c2ccc1c(c1nc(c(c3[nH]c(c(c4nc(c2-c2cc(OC)ccc2)cc4)CCCCC)cc3)-c2cc(OC)ccc2)cc1)-c1ccccc1 |
| SPLASH |
splash10-001i-0009004000-0f92e2ccb9ec55b2e400 |
| Source of Spectrum |
O1-65-2448-14 |
| Wiley ID |
1593252 |
