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Spectrum EAD002511 for methyl 3-(3-methylbut-2-enyl)-1,4-bis[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy]naphthalene-2-carboxylate_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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COC(=O)c1c(CC=C(C)C)c(OC2OC(CO)C(O)C(O)C2O)c2ccccc2c1OC1OC(CO)C(O)C(O)C1O
Mass Spectral Metadata
Name
Value
retentiontime
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1.0067156851607624
spectrum type
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MS2
precursormz
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611.2334324
formula
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C29H38O14
exactmass
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610.2261559
precursor type
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[M+H]+
ion mode
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P
spectrum entropy
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4.3802166
normalized entropy
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0.2583003722869708
origin
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ead_pfp.msp