Predicted LC-MS/MS Spectrum - 20V, Positive (HMDB0126789)
Spectrum Details
HMDB ID: | HMDB0126789 |
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Compound name: | {2-[2-(3,4-dihydroxyphenyl)-3,5,7-trihydroxy-4-[3,5,7-trihydroxy-2-(3-hydroxyphenyl)-3,4-dihydro-2H-1-benzopyran-8-yl]-3,4-dihydro-2H-1-benzopyran-6-yl]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl}oxidanesulfonic acid |
Spectrum type: | Predicted LC-MS/MS Spectrum - 20V, Positive |
Splash Key: | splash10-0670-0100029500-d24cb54557189e276452 |
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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Collision Energy: | 20 eV |
Instrument Type: | QTOF (generic), spectrum predicted by CFM-ID |
Mass Resolution: | 0.0001 Da |
Molecular Formula: | C36H36O19S |
Molecular Weight (Monoisotopic Mass): | 804.1572 Da |
Documentation
Document Description | Download | |
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List of m/z values for the spectrum (TXT) | Download file | 740 Bytes |
mzML formatted file (MZML) | Download file | 4.55 KB |
References
Not Available