![1,3-bis[tris(4-tert-butylphenyl)methyl]urea](/api/spectrum/J9e1hawU9pS/structure.png?h=300&w=458 "1,3-bis[tris(4-tert-butylphenyl)methyl]urea")
| SpectraBase Compound ID | BOo3OG9kmMJ |
|---|---|
| InChI | InChI=1S/C63H80N2O/c1-56(2,3)43-19-31-49(32-20-43)62(50-33-21-44(22-34-50)57(4,5)6,51-35-23-45(24-36-51)58(7,8)9)64-55(66)65-63(52-37-25-46(26-38-52)59(10,11)12,53-39-27-47(28-40-53)60(13,14)15)54-41-29-48(30-42-54)61(16,17)18/h19-42H,1-18H3,(H2,64,65,66) |
| InChIKey | QNMPFKXSDZUOCC-UHFFFAOYSA-N |
| Mol Weight | 881.3 g/mol |
| Molecular Formula | C63H80N2O |
| Exact Mass | 880.627065 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | J9e1hawU9pS |
|---|---|
| Name | 1,3-bis[tris(4-tert-butylphenyl)methyl]urea |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C63H80N2O |
| InChI | InChI=1S/C63H80N2O/c1-56(2,3)43-19-31-49(32-20-43)62(50-33-21-44(22-34-50)57(4,5)6,51-35-23-45(24-36-51)58(7,8)9)64-55(66)65-63(52-37-25-46(26-38-52)59(10,11)12,53-39-27-47(28-40-53)60(13,14)15)54-41-29-48(30-42-54)61(16,17)18/h19-42H,1-18H3,(H2,64,65,66) |
| InChIKey | QNMPFKXSDZUOCC-UHFFFAOYSA-N |
| Molecular Weight | 881.346 g/mol |
| SMILES | N(C(NC(c1ccc(C(C)(C)C)cc1)(c1ccc(C(C)(C)C)cc1)c1ccc(C(C)(C)C)cc1)=O)C(c1ccc(C(C)(C)C)cc1)(c1ccc(C(C)(C)C)cc1)c1ccc(C(C)(C)C)cc1 |
| SPLASH | splash10-0aor-9040800000-b4e7684d502907bb7439 |
| Source of Spectrum | F-51-7897-4 |
| Wiley ID | 792674 |