Propyl Propyl Pre final.1d
Dataset description:
This dataset contains NMR spectra obtained for the sample -Propyl Propyl Pre finaldate: 2020-09-28T22:50:27.000ZisFt: falsename: Propyl Propyl Pre final/1phc0: 235.6643phc1:...
Source: Propyl Propyl Pre final.1d
Chemical Info
| InChI | InChI=1S/C37H40BrNO4/c1-3-17-40-34-19-28-15-16-39-23-31-30(20-33(39)29(28)21-35(34)42-24-26-11-7-5-8-12-26)32(38)22-36(37(31)41-18-4-2)43-25-27-13-9-6-10-14-27/h5-14,19,21-22,33H,3-4,15-18,20,23-25H2,1-2H3/t33-/m0/s1 |
|---|---|
| SMILES | CCCOC1=C(OCC2=CC=CC=C2)C=C2C(=C1)CCN1CC3=C(C[C@@H]21)C(Br)=CC(OCC1=CC=CC=C1)=C3OCCC |
| InChI Key | XXEJHKDGMRVQFB-XIFFEERXSA-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 | d4f236a7-256a-4c15-8c3f-fcc26561a0f8 |
| Package id | nmrxiv-d633 |
| Resource type | HTML |
| State | active |