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Spectrum EAD002280 for [6-[3,4-dihydroxy-2,5-bis(hydroxymethyl)oxolan-2-yl]oxy-3,4,5-trihydroxyoxan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate_major
Originally submitted to the
EAD PFP NP lib
as PFP NP library
PFP NP library
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as JSON (Internal MoNA Format)
as MSP (NIST-compatible)
Submitter:
Fanzhou Kong
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Mass Spectrum
Ion Table / Peak Table
Similar Spectra
Compound Information
biological
Chemical Names
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as MOL file
as MoNA JSON Record
Compound Metadata
Name
Value
SMILES
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COc1cc(C=CC(=O)OCC2OC(OC3(CO)OC(CO)C(O)C3O)C(O)C(O)C2O)ccc1O
Mass Spectral Metadata
Name
Value
retentiontime
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0.6834500589582889
spectrum type
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MS2
precursormz
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541.1527736
formula
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C22H30O14
exactmass
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518.1635556
precursor type
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[M+Na]+
ion mode
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P
spectrum entropy
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4.3556824
normalized entropy
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0.27082547446544
origin
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ead_pfp.msp