Propyl cyclopentyl Pre-Final.1d
Dataset description:
This dataset contains NMR spectra obtained for the sample -Propyl cyclopentyl Pre-Final date: 2020-09-29T13:34:55.000ZisFt: falsename: Propyl cyclopentyl Pre-Final /1phc0: 232.765phc1:...
Source: Propyl cyclopentyl Pre-Final.1d
Chemical Info
InChI | InChI=1S/C39H42BrNO4/c1-2-19-42-36-20-29-17-18-41-24-33-32(21-35(41)31(29)22-37(36)43-25-27-11-5-3-6-12-27)34(40)23-38(39(33)45-30-15-9-10-16-30)44-26-28-13-7-4-8-14-28/h3-8,11-14,20,22-23,30,35H,2,9-10,15-19,21,24-26H2,1H3/t35-/m0/s1 |
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SMILES | CCCOC1=C(OCC2=CC=CC=C2)C=C2C(=C1)CCN1CC3=C(OC4CCCC4)C(OCC4=CC=CC=C4)=CC(Br)=C3C[C@@H]21 |
InChI Key | DITPAZYSGGCKHL-DHUJRADRSA-N |
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Additional Information
Field | Value |
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Data last updated | May 15, 2024 |
Metadata last updated | May 15, 2024 |
Created | May 15, 2024 |
Format | HTML |
License | No License Provided |
Id | 356cff41-52df-4327-bd4c-f23a8a1b2b33 |
Package id | nmrxiv-d643 |
Resource type | HTML |
State | active |