![1-(1-adamantyl)-3-[3-[[1-adamantyl(methyl)carbamoyl]amino]phenyl]-1-methyl-urea](/api/spectrum/E8QggCyL1yn/structure.png?h=300&w=458 "1-(1-adamantyl)-3-[3-[[1-adamantyl(methyl)carbamoyl]amino]phenyl]-1-methyl-urea")
| SpectraBase Compound ID | 7BzcRlfMzdH |
|---|---|
| InChI | InChI=1S/C30H42N4O2/c1-33(29-13-19-6-20(14-29)8-21(7-19)15-29)27(35)31-25-4-3-5-26(12-25)32-28(36)34(2)30-16-22-9-23(17-30)11-24(10-22)18-30/h3-5,12,19-24H,6-11,13-18H2,1-2H3,(H,31,35)(H,32,36)/t19-,20+,21-,22-,23?,24?,29-,30? |
| InChIKey | IHMQSPZSQGOZOL-HITUCYHESA-N |
| Mol Weight | 490.7 g/mol |
| Molecular Formula | C30H42N4O2 |
| Exact Mass | 490.330777 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | E8QggCyL1yn |
|---|---|
| Name | 1-(1-adamantyl)-3-[3-[[1-adamantyl(methyl)carbamoyl]amino]phenyl]-1-methyl-urea |
| Alternate Name(s) | 1-(1-adamantyl)-3-[3-[[[1-adamantyl(methyl)amino]-oxomethyl]amino]phenyl]-1-methylurea |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H42N4O2 |
| InChI | InChI=1S/C30H42N4O2/c1-33(29-13-19-6-20(14-29)8-21(7-19)15-29)27(35)31-25-4-3-5-26(12-25)32-28(36)34(2)30-16-22-9-23(17-30)11-24(10-22)18-30/h3-5,12,19-24H,6-11,13-18H2,1-2H3,(H,31,35)(H,32,36)/t19-,20+,21-,22-,23?,24?,29-,30? |
| InChIKey | IHMQSPZSQGOZOL-HITUCYHESA-N |
| Molecular Weight | 490.692 g/mol |
| SMILES | N(C(N(C12CC3CC(C2)CC(C1)C3)C)=O)c1cc(NC(N(C23C[C@]4(C[C@@](C3)(C[C@@](C2)(C4)[H])[H])[H])C)=O)ccc1 |
| SPLASH | splash10-0a4i-2900000000-43a82d706e78f9783012 |
| Wiley ID | 1460775 |