distortionless enhancement with polarization...
URL: https://doi.org/10.14272/NIQVJDCFQXEZFB-UHFFFAOYSA-M/CHMO0000596
Dataset description:
dataset for distortionless enhancement with polarization transfer (DEPT)
Chemical Info
InChI | InChI=1S/C44H36N2O4P.BrH/c1-30-42(29-51(35-13-7-4-8-14-35,36-15-9-5-10-16-36)37-17-11-6-12-18-37)46-41-28-39(32-21-25-34(26-22-32)44(48)50-3)38(27-40(41)45-30)31-19-23-33(24-20-31)43(47)49-2;/h4-28H,29H2,1-3H3;1H/q+1;/p-1 |
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SMILES | COC(=O)c1ccc(-c2cc3nc(C)c(C[P+](c4ccccc4)(c4ccccc4)c4ccccc4)nc3cc2-c2ccc(C(=O)OC)cc2)cc1.[Br-] |
InChI Key | NIQVJDCFQXEZFB-UHFFFAOYSA-M |
Molecular Formula | C44H36BrN2O4P |
Exact Mass | 767.660 g/mol |
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Additional Information
Field | Value |
---|---|
Data last updated | unknown |
Metadata last updated | October 6, 2022 |
Created | unknown |
Format | HTML |
License | Attribution-ShareAlike 4.0 International (CC BY-SA 4.0) |
Created | 2 years ago |
Id | c7d1cad3-a305-4f92-99ca-277587b0c1fd |
Package id | 10-14272-niqvjdcfqxezfb-uhfffaoysa-m-chmo0000596 |
Resource type | HTML |
State | active |