| SpectraBase Spectrum ID |
6oSftoFnU3F |
| Name |
3,21-Diisopropyl-6,7,8,9,10,11,12,13,14,15,16,17,24,25,26,27,28,29,30,31,32,33,34,35-tetracosahydrodicyclohepta[b,q][1,4,16,19]tetrazacyclotricontine |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C42H68N4 |
| InChI |
InChI=1S/C42H68N4/c1-35(2)37-23-27-39-40(28-24-37)44-32-20-16-12-8-6-10-14-18-22-34-46-42-30-26-38(36(3)4)25-29-41(42)45-33-21-17-13-9-5-7-11-15-19-31-43-39/h23-30,35-36,43,46H,5-22,31-34H2,1-4H3/b44-40-,45-41- |
| InChIKey |
QWTKZQYLVCYOIC-ACYPRQGXSA-N |
| Molecular Weight |
629.034 g/mol |
| SMILES |
N1C=2\C(=N/CCCCCCCCCCCNC=3\C(C=CC(=CC3)C(C)C)=N/CCCCCCCCCCC1)C=CC(=CC2)C(C)C |
| SPLASH |
splash10-0fbi-0000095000-5f3845d6328e15395964 |
| Source of Spectrum |
H1-40-921-4 |
| Synonyms |
3,21-diisopropyl-6,7,8,9,10,11,12,13,14,15,16,17,24,25,26,27,28,29,30,31,32,33,34,35-tetracosahydrodicyclohepta[b,q][1,4,16,19]tetraazacyclotriacontine |
| Wiley ID |
756984 |
![3,21-DIISOPROPYL-6,7,8,9,10,11,12,13,14,15,16,17,24,25,26,27,28,29,30,31,32,33,34,35-TETRACOSAHYDRODICYCLOHEPTA-[B,Q]-[1,4,16,19]-TRIACONTINE](/api/spectrum/6oSftoFnU3F/structure.png?h=300&w=458 "3,21-DIISOPROPYL-6,7,8,9,10,11,12,13,14,15,16,17,24,25,26,27,28,29,30,31,32,33,34,35-TETRACOSAHYDRODICYCLOHEPTA-[B,Q]-[1,4,16,19]-TRIACONTINE")
