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Spectrum CCMSLIB00000577957 for PICOLINIC ACID
Originally submitted to the
Global Natural Product Social Molecular Networking Library
as GNPS
GNPS
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as JSON (Internal MoNA Format)
as MSP (NIST-compatible)
Submitter:
GNPS Team
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Mass Spectrum
Ion Table / Peak Table
Similar Spectra
Compound Information
Chemical Names
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as MOL file
as MoNA JSON Record
Compound Metadata
Name
Value
cas number
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98-98-6
pubmed id
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1018
SMILES
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O=C(O)c1ncccc1
Mass Spectral Metadata
Name
Value
ion source
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LC-ESI
compound source
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Commercial standard
instrument
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Q-Exactive Plus
adduct
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[M+H]+
precursor mz
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124.04
exactmass
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123.032
charge
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0
ion mode
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Positive
source file
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IROA_PLATE_pos_2_E.mzXML
ms level
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2
origin
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GNPS-EMBL-MCF
authors
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Alexandrov Theodore, pphapale, Prasad