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Predicted GC-MS Spectrum - GC-MS (TBDMS_1_2) - 70eV, Positive (M2MDB000097)
Spectrum Details
| ECMDB ID: | ECMDB00235 |
|---|---|
| Compound Name: | Thiamine |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (TBDMS_1_2) - 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: | C12H17N4OS |
| Molecular Weight (Monoisotopic Mass): | 265.1123 Da |
| Molecular Weight (Avergae Mass): | 265.355 Da |
| Derivative Type: | TBDMS_1_2 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CC1=NC=C(C[N+]2=CSC(CCO)=C2C)C(N[Si](C)(C)C(C)(C)C)=N1)
Documentation
| Document Description | Download |
|---|---|
| List of m/z values for the spectrum | Download file |
References
Not Available