Propyl Ethyl Prefinal.1d
Dataset description:
This dataset contains NMR spectra obtained for the sample -Propyl Ethyl Prefinaldate: 2020-09-29T23:47:05.000ZisFt: falsename: Propyl Ethyl Prefinal/1phc0: 232.6691phc1: -0.2719498type:...
Source: Propyl Ethyl Prefinal.1d
Chemical Info
| InChI | InChI=1S/C36H38BrNO4/c1-3-17-40-33-18-27-15-16-38-22-30-29(19-32(38)28(27)20-34(33)41-23-25-11-7-5-8-12-25)31(37)21-35(36(30)39-4-2)42-24-26-13-9-6-10-14-26/h5-14,18,20-21,32H,3-4,15-17,19,22-24H2,1-2H3/t32-/m0/s1 |
|---|---|
| SMILES | CCCOC1=C(OCC2=CC=CC=C2)C=C2C(=C1)CCN1CC3=C(OCC)C(OCC4=CC=CC=C4)=CC(Br)=C3C[C@@H]21 |
| InChI Key | BWIQAVJNDIBWCE-YTTGMZPUSA-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 | d2f967a2-e4ec-4472-9954-853a944b29c4 |
| Package id | nmrxiv-d581 |
| Resource type | HTML |
| State | active |