Propyl butyl.1d
Dataset description:
This dataset contains NMR spectra obtained for the sample -Propyl butyldate: 2020-10-01T02:35:34.000ZisFt: falsename: Propyl butyl/1phc0: 232.888phc1: 4.441597type: NMR FIDDECIM: 24aqMod:...
Source: Propyl butyl.1d
Chemical Info
| InChI | InChI=1S/C24H30BrNO4/c1-3-5-9-30-24-18-14-26-7-6-15-10-23(29-8-4-2)21(27)12-16(15)20(26)11-17(18)19(25)13-22(24)28/h10,12-13,20,27-28H,3-9,11,14H2,1-2H3/t20-/m0/s1 |
|---|---|
| SMILES | CCCCOC1=C2CN3CCC4=CC(OCCC)=C(O)C=C4[C@@H]3CC2=C(Br)C=C1O |
| InChI Key | ANDDNJUYPNMKJQ-FQEVSTJZSA-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 | 3e3144ff-dcef-4a99-8641-c5ba2e0297cc |
| Package id | nmrxiv-d666 |
| Resource type | HTML |
| State | active |