Predicted GC-MS Spectrum - GC-MS (1 TMS) - 70eV, Positive (CDB000225)
Spectrum Details
| CDB ID: | CDB000225 |
|---|---|
| Compound Name: | (+)-lariciresinol |
| Derivative IUPAC Name: | 4-{[(3R,4R,5S)-4-(hydroxymethyl)-5-{3-methoxy-4-[(trimethylsilyl)oxy]phenyl}oxolan-3-yl]methyl}-2-methoxyphenol |
| Derivative SMILES: | COC1=CC(C[C@H]2CO[C@H](C3=CC=C(O[Si](C)(C)C)C(OC)=C3)[C@H]2CO)=CC=C1O |
| Derivative InChIKey: | InChIKey=XLBDOSAZSMFAAD-IUKKYPGJSA-N |
| Spectrum Type: | Predicted GC-MS Spectrum - GC-MS (1 TMS) - 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: | C23H32O6Si |
| Molecular Weight (Monoisotopic Mass): | 432.197 Da |
| Derivative Type: | 1 TMS |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: COC1=CC(C[C@H]2CO[C@H](C3=CC=C(O[Si](C)(C)C)C(OC)=C3)[C@H]2CO)=CC=C1O)
Documentation
| Document Description | Download | File Size |
|---|---|---|
| List of m/z values for the spectrum (TXT) | Download file | 751 Bytes |
| mzML formatted file (MZML) | Download file | 4.68 KB |
References
Not Available