GNPS Library Spectrum CCMSLIB00000078920

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Latest Library Spectrum Information
Spectrum IDCCMSLIB00000078920
Compound Name(E)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acid
PIDorrestein
Data CollectorGarg_Neha
CAS NumberN/A
Original Submitternegarg
Most Recent Revisornegarg
Library QualityGold Spectrum
SmilesOC(=O)/C=C/c1ccc(Cn2ccnc2)cc1
InChIN/A
Structure
NPAtlas/MIBiG
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Metabolomics Spectrum Resolvermzspec:GNPS:GNPS-NIH-CLINICALCOLLECTION1:accession:CCMSLIB00000078920
Precursor M/Z229.097
Exact Mass228.09
Charge1
Adduct[M+H]
Ion SourceLC-ESI
InstrumentqTof
Ion ModePositive
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Library MembershipGNPS-NIH-CLINICALCOLLECTION1
SPLASH Keysplash10-03di-0920000000-6dcd8086c8924bc1988e
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Spectrum Annotation History

Spectrum Annotations and Comments
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CommentCompound NamePIAdductData_CollectorPrecursor_MZuser_idPubmed IDTime
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1Comment(E)-3-[4-(imidazol-1-ylmethyl)phenyl]prop-2-enoic acidDorrestein[M+H]Garg_Neha229.097negargN/A2014-05-06 20:38:41.0

Spectrum ID Ratings