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Spectrum EAD002221 for 12-(acetyloxy)-6-(furan-3-yl)-14-hydroxy-1,7,11,15,15-pentamethyl-5-oxo-3-oxapentacyclo[8.8.0.0²,⁴.0²,⁷.0¹¹,¹⁶]octadecan-18-yl acetate_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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as MoNA JSON Record
Compound Metadata
Name
Value
SMILES
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CC(=O)OC1CC(O)C(C)(C)C2CC(OC(C)=O)C3(C)C(CCC4(C)C(c5ccoc5)C(=O)C5OC543)C12C
Mass Spectral Metadata
Name
Value
retentiontime
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2.364750272631152
spectrum type
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MS2
precursormz
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529.2795947
formula
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C30H40O8
exactmass
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528.2723182
precursor type
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[M+H]+
ion mode
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P
spectrum entropy
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4.5662174
normalized entropy
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0.500306781008475
origin
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ead_pfp.msp