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Biological Magnetic Resonance Data BankA Repository for Data from NMR Spectroscopy on Proteins, Peptides, Nucleic Acids, and other Biomolecules |
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Tetramethylammonium (C4H12N+)
BMRB entry bmse000780
Entry DOI: doi:10.13018/BMSE000780
Data source: Madison Metabolomics Consortium - Francisca Jofre, Mark E. Anderson, John L. Markley, Ravi Rapolu
NMR-STAR file: bmse000780.str
NMR-STAR interactive viewer
Structure file (mol/sdf): bmse000780.mol
All files for bmse000780
Time Domain Data: bmse000780.zip
View the GISSMO record for this entry.
Sample and instrument details are given with the spectrum
Assigned chemical shifts
Set 1
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
| Atom ID | Author Nomenclature | Value | Ambiguity Code |
|---|---|---|---|
| C1 | C2 | 57.963 | 1 |
| C2 | C3 | 57.963 | 1 |
| C3 | C4 | 57.963 | 1 |
| C4 | C5 | 57.963 | 1 |
| H15 | H6 | 3.18 | 1 |
| H16 | H7 | 3.18 | 1 |
| H17 | H8 | 3.18 | 1 |
| H12 | H9 | 3.18 | 1 |
| H13 | H10 | 3.18 | 1 |
| H14 | H11 | 3.18 | 1 |
| H9 | H12 | 3.18 | 1 |
| H10 | H13 | 3.18 | 1 |
| H11 | H14 | 3.18 | 1 |
| H6 | H15 | 3.18 | 1 |
| H7 | H16 | 3.18 | 1 |
| H8 | H17 | 3.18 | 1 |
NMR experiments
1: 1D 1H
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
2: 2D [1H,1H]-TOCSY
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
3: 1D 13C
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
4: 1D DEPT90
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
5: 1D DEPT135
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
6: 2D [1H,13C]-HSQC
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
7: 2D [1H,13C]-HMBC
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
8: 2D [1H,1H]-COSY
Sample: 100mM in D2O, ref: DSS
Conditions: temperature: 298K, pH: 7.4
Spectrometer: Bruker DMX - 500MHz
