Predicted GC-MS Spectrum - 2-({4-[5-(3,4-Diethoxyphenyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl}amino)ethan-1-ol GC-MS (TMS_1_2) - 70eV, Positive (HMDB0244335)
Spectrum Details
| HMDB ID: | HMDB0244335 |
|---|---|
| Compound Name: | 2-({4-[5-(3,4-Diethoxyphenyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl}amino)ethan-1-ol |
| Derivative IUPAC Name: | Not Available |
| Derivative SMILES: | CCOC1=CC=C(C2=NC(C3=CC=CC4=C3CCC4N(CCO)[Si](C)(C)C)=NO2)C=C1OCC |
| Derivative InChIKey: | Not Available |
| Spectrum Type: | Predicted GC-MS Spectrum - 2-({4-[5-(3,4-Diethoxyphenyl)-1,2,4-oxadiazol-3-yl]-2,3-dihydro-1H-inden-1-yl}amino)ethan-1-ol GC-MS (TMS_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
Relative Intensity
m/z
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: | C23H27N3O4 |
| Molecular Weight (Monoisotopic Mass): | 409.2002 Da |
| Derivative Type: | TMS_1_2 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CCOC1=CC=C(C2=NC(C3=CC=CC4=C3CCC4N(CCO)[Si](C)(C)C)=NO2)C=C1OCC)
Documentation
| Document Description | Download | File Size |
|---|---|---|
| List of m/z values for the spectrum (TXT) | Download file | 745 Bytes |
| mzML formatted file (MZML) | Download file | 4.66 KB |
References
Not Available