Propyl Butyl Pre-Final.1d
Dataset description:
This dataset contains NMR spectra obtained for the sample -Propyl Butyl Pre-Finaldate: 2020-09-29T13:00:25.000ZisFt: falsename: Propyl Butyl Pre-Final/1phc0: 232.1958phc1: 1.907955type:...
Source: Propyl Butyl Pre-Final.1d
Chemical Info
| InChI | InChI=1S/C38H42BrNO4/c1-3-5-19-42-38-32-24-40-17-16-29-20-35(41-18-4-2)36(43-25-27-12-8-6-9-13-27)22-30(29)34(40)21-31(32)33(39)23-37(38)44-26-28-14-10-7-11-15-28/h6-15,20,22-23,34H,3-5,16-19,21,24-26H2,1-2H3/t34-/m0/s1 |
|---|---|
| SMILES | CCCCOC1=C2CN3CCC4=CC(OCCC)=C(OCC5=CC=CC=C5)C=C4[C@@H]3CC2=C(Br)C=C1OCC1=CC=CC=C1 |
| InChI Key | CYSLTUAOQSOTJP-UMSFTDKQSA-N |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | May 15, 2024 |
| Metadata last updated | May 15, 2024 |
| Created | May 15, 2024 |
| Format | HTML |
| License | No License Provided |
| Id | 139f4628-7fdb-49b1-b6a1-bb5bdfa1edbc |
| Package id | nmrxiv-d680 |
| Resource type | HTML |
| State | active |