Propyl Hexyl Pre-Final.1d
Dataset description:
This dataset contains NMR spectra obtained for the sample -Propyl Hexyl Pre-Finaldate: 2020-09-29T14:09:32.000ZisFt: falsename: Propyl Hexyl Pre-Final/1phc0: 232.0792phc1: 3.179977type:...
Source: Propyl Hexyl Pre-Final.1d
Chemical Info
| InChI | InChI=1S/C40H46BrNO4/c1-3-5-6-13-21-44-40-34-26-42-19-18-31-22-37(43-20-4-2)38(45-27-29-14-9-7-10-15-29)24-32(31)36(42)23-33(34)35(41)25-39(40)46-28-30-16-11-8-12-17-30/h7-12,14-17,22,24-25,36H,3-6,13,18-21,23,26-28H2,1-2H3/t36-/m0/s1 |
|---|---|
| SMILES | CCCCCCOC1=C2CN3CCC4=CC(OCCC)=C(OCC5=CC=CC=C5)C=C4[C@@H]3CC2=C(Br)C=C1OCC1=CC=CC=C1 |
| InChI Key | GFILPRGUBNVABK-BHVANESWSA-N |
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Additional Information
| Field | Value |
|---|---|
| Data last updated | February 3, 2025 |
| Metadata last updated | February 3, 2025 |
| Created | February 3, 2025 |
| Format | HTML |
| License | No License Provided |
| Id | 81959349-be4d-4e55-8e6b-f8ea9e635ecb |
| Package id | nmrxiv-d715 |
| Resource type | HTML |
| State | active |