Predicted GC-MS Spectrum - GC-MS (TMS_2_17) - 70eV, Positive (LMDB00177)
Spectrum Details
| LMDB ID: | LMDB00177 |
|---|---|
| Compound Name: | Adenosine triphosphate |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (TMS_2_17) - 70eV, Positive |
| Splash Key: | Not Available |
| Notes: | This is a predicted spectrum, and it should only be used as a guide. Further evidence is required to confirm identification. |
Spectrum View
Experimental Conditions
| Ionization Mode: | Positive |
|---|---|
| Ionization Energy: | 70 eV |
| Chromatography Type: | Gas Chromatography Column (GC) |
| Instrument Type: | Single quadrupole, spectrum predicted by CFM-ID(EI) |
| Mass Resolution: | 0.0001 Da |
| Molecular Formula: | C10H16N5O13P3 |
| Molecular Weight (Monoisotopic Mass): | 506.9957 Da |
| Molecular Weight (Avergae Mass): | 507.181 Da |
| Derivative Type: | TMS_2_17 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: C[Si](C)(C)N(C1=NC=NC2=C1N=CN2[C@@H]1O[C@H](COP(=O)(O)OP(=O)(O)OP(=O)(O)O)[C@@H](O)[C@H]1O)[Si](C)(C)C)
Documentation
| Document Description | Download |
|---|---|
| List of m/z values for the spectrum | Download file |
| mzML formatted file | Download file |
References
Not Available