GNPS Library Spectrum CCMSLIB00000077045

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Latest Library Spectrum Information
Spectrum IDCCMSLIB00000077045
Compound NameCAPTOPRIL
PIDorrestein
Data CollectorGarg_Neha
CAS NumberN/A
Original Submitternegarg
Most Recent Revisornegarg
Library QualityGold Spectrum
SmilesN/A
InChIC[C@H](CS)C(=O)N1CCC[C@H]1C(=O)O
Structure
NPAtlas/MIBiG
External Chemical ResourcesView All External Resources
Metabolomics Spectrum Resolvermzspec:GNPS:GNPS-NIH-CLINICALCOLLECTION2:accession:CCMSLIB00000077045
Precursor M/Z218.085
Exact Mass217.077
Charge1
Adduct[M+H]
Ion SourceLC-ESI
InstrumentqTof
Ion ModePositive
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Library MembershipGNPS-NIH-CLINICALCOLLECTION2
SPLASH Keysplash10-014i-0940000000-26ddf220b67fb8dcdff0
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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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1CommentCAPTOPRILDorrestein[M+H]Garg_Neha218.085negargN/A2014-04-21 17:25:35.0

Spectrum ID Ratings