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Spectrum EAD001945 for Dihydrogedunin_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
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Compound Metadata
Name
Value
SMILES
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CC(=O)OC1CC2C(C)(C)C(=O)CCC2(C)C2CCC3(C)C(c4ccoc4)OC(=O)C4OC43C12C
Mass Spectral Metadata
Name
Value
retentiontime
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2.286697198545236
spectrum type
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MS2
precursormz
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485.25338
formula
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C28H36O7
exactmass
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484.2461035
precursor type
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[M+H]+
ion mode
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P
spectrum entropy
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4.476498
normalized entropy
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0.4729004725191458
origin
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ead_pfp.msp