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Spectrum EAD001311 for Riboflavin_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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Cc1cc2nc3c(=O)[nH]c(=O)nc-3n(CC(O)C(O)C(O)CO)c2cc1C
Mass Spectral Metadata
Name
Value
retentiontime
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0.562846205639633
spectrum type
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MS2
precursormz
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399.1275024
formula
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C17H20N4O6
exactmass
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376.1382844
precursor type
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[M+Na]+
ion mode
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P
spectrum entropy
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4.5772295
normalized entropy
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0.3764483129017968
origin
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ead_pfp.msp