| SpectraBase Spectrum ID |
B2Shyv06wrI |
| Name |
13,17-Diethyl-2,8,12,18-tetramethyl-3,5-(3,3-dimethylpropano)porphyrin |
| Alternate Name(s) |
13,17-diethyl-3,3,12,18,22,27-hexamethyl-8,24,25,26-tetraazahexacyclo[19.2.1.1(6,9).1(11,14).1(16,19).0(2,7)]heptacosa-1,6(27),7,9,11,13,15,17,19(25),20,22-undecaene |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C33H38N4 |
| InChI |
InChI=1S/C33H38N4/c1-9-21-18(4)25-14-24-17(3)13-30(34-24)31-32-23(11-12-33(31,7)8)20(6)27(37-32)15-26-19(5)22(10-2)29(36-26)16-28(21)35-25/h13-16,34,36H,9-12H2,1-8H3/b24-14+,25-14+,26-15+,27-15+,28-16+,29-16+,31-30+ |
| InChIKey |
LJCFBXGJXZEYKQ-MFMWVHHCSA-N |
| Molecular Weight |
490.695 g/mol |
| SMILES |
[nH]1c2c(c(c1cc1nc(cc3[nH]c(c4c5nc(c2)c(c5CCC4(C)C)C)cc3C)c(c1CC)C)CC)C |
| SPLASH |
splash10-002f-0000900000-b6059b4cb3dee40dba45 |
| Source of Spectrum |
KC-61-11638-13 |
| Wiley ID |
1631519 |
