![Dibutylbis[(4S)-4-[(3-Methyl-1H-imidazolium-4-yl)methyl]-3-propionyl-2-oxazolidinone]boranephosphoic acid complex](/api/spectrum/HUbxMpkZsVj/structure.png?h=300&w=458 "Dibutylbis[(4S)-4-[(3-Methyl-1H-imidazolium-4-yl)methyl]-3-propionyl-2-oxazolidinone]boranephosphoic acid complex")
| SpectraBase Compound ID | 7ocvf1ATJ9N |
|---|---|
| InChI | InChI=1S/C30H48BN6O6.H3O4P/c1-5-27(38)36-25(19-42-29(36)40)15-23-17-34(21-32(23)3)13-9-7-11-31-12-8-10-14-35-18-24(33(4)22-35)16-26-20-43-30(41)37(26)28(39)6-2;1-5(2,3)4/h17-18,21-22,25-26H,5-16,19-20,31H2,1-4H3;(H3,1,2,3,4)/q+3;/p-1/t25-,26-;/m0./s1 |
| InChIKey | AMIGWFKMABMQCK-CCQIZPNASA-M |
| Mol Weight | 696.5 g/mol |
| Molecular Formula | C30H50BN6O10P |
| Exact Mass | 696.341909 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | HUbxMpkZsVj |
|---|---|
| Name | Dibutylbis[(4S)-4-[(3-Methyl-1H-imidazolium-4-yl)methyl]-3-propionyl-2-oxazolidinone]boranephosphoic acid complex |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H50BN6O10P |
| InChI | InChI=1S/C30H48BN6O6.H3O4P/c1-5-27(38)36-25(19-42-29(36)40)15-23-17-34(21-32(23)3)13-9-7-11-31-12-8-10-14-35-18-24(33(4)22-35)16-26-20-43-30(41)37(26)28(39)6-2;1-5(2,3)4/h17-18,21-22,25-26H,5-16,19-20,31H2,1-4H3;(H3,1,2,3,4)/q+3;/p-1/t25-,26-;/m0./s1 |
| InChIKey | AMIGWFKMABMQCK-CCQIZPNASA-M |
| Molecular Weight | 696.546 g/mol |
| SMILES | OP([O-])(=O)O.C1(N([C@](CO1)(Cc1[n](c[n+](c1)CCCC[BH2+]CCCC[n+]1c[n](C)c(c1)C[C@@]1(N(C(=O)OC1)C(=O)CC)[H])C)[H])C(=O)CC)=O |
| SPLASH | splash10-000j-9850000000-80b53f4d2bde959b2bee |
| Source of Spectrum | AJ-64-679-14 |
| Wiley ID | 771021 |