| SpectraBase Spectrum ID |
DKSyqTPN03M |
| Name |
Dimethyl 3,3'-[3"-(1"'-benzoyloxybut-3"'-en-1"'-yl)-2",7",12",18"-tetramethyl-21H.23H-porphyrin-13",17"-diyl]-dipropionate |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C43H44N4O6 |
| InChI |
InChI=1S/C43H44N4O6/c1-8-12-39(53-43(50)28-13-10-9-11-14-28)42-27(5)35-22-34-26(4)31(16-18-41(49)52-7)37(46-34)23-36-30(15-17-40(48)51-6)25(3)33(45-36)20-29-19-24(2)32(44-29)21-38(42)47-35/h8-11,13-14,19-23,39,45,47H,1,12,15-18H2,2-7H3/b29-20-,32-21-,33-20-,34-22-,35-22-,36-23-,37-23-,38-21- |
| InChIKey |
ISBVAMCBZUVCGU-BTURKJBKSA-N |
| Molecular Weight |
712.847 g/mol |
| SMILES |
[nH]1c2c(c(c1cc1nc(cc3[nH]c(cc4nc(c2)c(c4CCC(=O)OC)C)c(c3C)CCC(=O)OC)cc1C)C(OC(=O)c1ccccc1)CC=C)C |
| SPLASH |
splash10-0006-0000090000-5ef8b27ce975778e7f6c |
| Source of Spectrum |
U-1995-1037-10 |
| Wiley ID |
767005 |
![Dimethyl 3,3'-[3"-(1"'-benzoyloxybut-3"'-en-1"'-yl)-2",7",12",18"-tetramethyl-21H.23H-porphyrin-13",17"-diyl]-dipropionate](/api/spectrum/DKSyqTPN03M/structure.png?h=300&w=458 "Dimethyl 3,3'-[3\"-(1\"'-benzoyloxybut-3\"'-en-1\"'-yl)-2\",7\",12\",18\"-tetramethyl-21H.23H-porphyrin-13\",17\"-diyl]-dipropionate")
