GNPS Library Spectrum CCMSLIB00000079225

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Latest Library Spectrum Information
Spectrum IDCCMSLIB00000079225
Compound Name"(5R,9R,Z)-5-amino-11-ethylidene-7-methyl-5,6,9,10-tetrahydro-5,9-methanocycloocta[b]pyridin-2-ol"
PIDorrestein
Data CollectorGarg_Neha
CAS NumberN/A
Original Submitternegarg
Most Recent Revisornegarg
Library QualityGold Spectrum
SmilesC/C=C\1/[C@@H]2Cc3nc(O)ccc3[C@@]1(N)CC(=C2)C
InChIN/A
Structure
NPAtlas/MIBiG
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Metabolomics Spectrum Resolvermzspec:GNPS:GNPS-NIH-CLINICALCOLLECTION1:accession:CCMSLIB00000079225
Precursor M/Z243.149
Exact Mass242.142
Charge1
Adduct[M+H]
Ion SourceLC-ESI
InstrumentqTof
Ion ModePositive
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Library MembershipGNPS-NIH-CLINICALCOLLECTION1
SPLASH Keysplash10-004i-0690000000-b3622c27684d87c37915
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Spectrum Annotations and Comments
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CommentCompound NamePIAdductData_CollectorPrecursor_MZuser_idPubmed IDTime
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1Comment"(5R,9R,Z)-5-amino-11-ethylidene-7-methyl-5,6,9,10-tetrahydro-5,9-methanocycloocta[b]pyridin-2-ol"Dorrestein[M+H]Garg_Neha243.149negargN/A2014-05-06 20:38:41.0

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