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Spectrum EAD001402 for (2S,3R,4S,5S,6R)-2-[3-hydroxy-5-[(Z)-2-(4-hydroxyphenyl)ethenyl]phenoxy]-6-(hydroxymethyl)oxane-3,4,5-triol_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
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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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OCC1OC(Oc2cc(O)cc(C=Cc3ccc(O)cc3)c2)C(O)C(O)C1O
Mass Spectral Metadata
Name
Value
retentiontime
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1.177811341257369
spectrum type
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MS2
precursormz
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413.1206857
formula
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C20H22O8
exactmass
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390.1314677
precursor type
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[M+Na]+
ion mode
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P
spectrum entropy
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4.92364
normalized entropy
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0.674148268151858
origin
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ead_pfp.msp