Predicted GC-MS Spectrum - Physalin E acetate GC-MS (TBDMS_2_2) - 70eV, Positive (HMDB0031878)
Spectrum Details
HMDB ID: | HMDB0031878 |
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Compound Name: | Physalin E acetate |
Derivative IUPAC Name: | Not Available |
Derivative SMILES: | CC(=O)OC1CC2(O[Si](C)(C)C(C)(C)C)CC=CC(=O)C2(C)C2CCC3(O)C(=O)OC4(C)C5CC6(C)C7=C(O[Si](C)(C)C(C)(C)C)C(OCC6C(=O)O5)(OC734)C12 |
Derivative InChIKey: | Not Available |
Spectrum Type: | Predicted GC-MS Spectrum - Physalin E acetate GC-MS (TBDMS_2_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 |
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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: | C30H34O12 |
Molecular Weight (Monoisotopic Mass): | 586.205 Da |
Derivative Type: | TBDMS_2_2 |
Notes
Predicted by CFMID-EI, 70eV, fully TMS-derivatized (structure: CC(=O)OC1CC2(O[Si](C)(C)C(C)(C)C)CC=CC(=O)C2(C)C2CCC3(O)C(=O)OC4(C)C5CC6(C)C7=C(O[Si](C)(C)C(C)(C)C)C(OCC6C(=O)O5)(OC734)C12)
Documentation
Document Description | Download | File Size |
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List of m/z values for the spectrum (TXT) | Download file | 751 Bytes |
mzML formatted file (MZML) | Download file | 4.66 KB |
References
Not Available