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Predicted GC-MS Spectrum - GC-MS (TBDMS_3_6) - 70eV, Positive (M2MDB000876)
Spectrum Details
| ECMDB ID: | ECMDB20027 |
|---|---|
| Compound Name: | 1-Nitro-7-hydroxy-8-glutathionyl-7,8-dihydronaphthalene |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (TBDMS_3_6) - 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: | C20H24N4O9S |
| Molecular Weight (Monoisotopic Mass): | 496.1264 Da |
| Molecular Weight (Avergae Mass): | 496.491 Da |
| Derivative Type: | TBDMS_3_6 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CC(C)(C)[Si](C)(C)OC(=O)CN=C(O)[C@H](CSC1C2=C(C=CC1O[Si](C)(C)C(C)(C)C)C=CC=C2[N+](=O)[O-])N=C(CC[C@H](N)C(=O)O)O[Si](C)(C)C(C)(C)C)
Documentation
| Document Description | Download |
|---|---|
| List of m/z values for the spectrum | Download file |
References
Not Available