![3,20-Diisopropyl-6,7,8,9,10,11,12,13,14,15,16,23,24,25,26,27,28,29,30,31,32,33-docosahydrodicyclohepta[b,p][1,4,15,18]tetraazacyclooctacosine](/api/spectrum/BS5uFdbIRz2/structure.png?h=300&w=458 "3,20-Diisopropyl-6,7,8,9,10,11,12,13,14,15,16,23,24,25,26,27,28,29,30,31,32,33-docosahydrodicyclohepta[b,p][1,4,15,18]tetraazacyclooctacosine")
| SpectraBase Compound ID | I1UOkDlYuDZ |
|---|---|
| InChI | InChI=1S/C40H64N4/c1-33(2)35-21-25-37-38(26-22-35)42-30-18-14-10-6-8-12-16-20-32-44-40-28-24-36(34(3)4)23-27-39(40)43-31-19-15-11-7-5-9-13-17-29-41-37/h21-28,33-34,41,44H,5-20,29-32H2,1-4H3/b42-38-,43-39- |
| InChIKey | TZPLWVPGJWZXFF-CLUUJJAHSA-N |
| Mol Weight | 601.0 g/mol |
| Molecular Formula | C40H64N4 |
| Exact Mass | 600.513098 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | BS5uFdbIRz2 |
|---|---|
| Name | 3,20-Diisopropyl-6,7,8,9,10,11,12,13,14,15,16,23,24,25,26,27,28,29,30,31,32,33-docosahydrodicyclohepta[b,p][1,4,15,18]tetraazacyclooctacosine |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C40H64N4 |
| InChI | InChI=1S/C40H64N4/c1-33(2)35-21-25-37-38(26-22-35)42-30-18-14-10-6-8-12-16-20-32-44-40-28-24-36(34(3)4)23-27-39(40)43-31-19-15-11-7-5-9-13-17-29-41-37/h21-28,33-34,41,44H,5-20,29-32H2,1-4H3/b42-38-,43-39- |
| InChIKey | TZPLWVPGJWZXFF-CLUUJJAHSA-N |
| Molecular Weight | 600.980 g/mol |
| SMILES | N1C=2\C(=N/CCCCCCCCCCNC=3\C(C=CC(=CC3)C(C)C)=N/CCCCCCCCCC1)C=CC(=CC2)C(C)C |
| SPLASH | splash10-0uk9-0000901000-50c6bcf62a8193ac1630 |
| Source of Spectrum | H1-40-921-4 |
| Wiley ID | 756985 |