MassBank Record: KO001381



 5-Methoxytryptamine; LC-ESI-QQ; MS2; CE:30 V; [M-H]- 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO001381
RECORD_TITLE: 5-Methoxytryptamine; LC-ESI-QQ; MS2; CE:30 V; [M-H]-
DATE: 2016.01.19 (2007.07.07, 2011.05.10)
AUTHORS: Kakazu YInstitute for Advanced Biosciences, Keio Univ., Horai HInstitute for Advanced Biosciences, Keio Univ., Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID M040

CH$NAME: 5-Methoxytryptamine CH$COMPOUND_CLASS: N/A CH$FORMULA: C11H14N2O CH$EXACT_MASS: 190.11061 CH$SMILES: COC1=CC2=C(C=C1)NC=C2CCN CH$IUPAC: InChI=1S/C11H14N2O/c1-14-9-2-3-11-10(6-9)8(4-5-12)7-13-11/h2-3,6-7,13H,4-5,12H2,1H3 CH$LINK: CAS 608-07-1 CH$LINK: KEGG C05659 CH$LINK: NIKKAJI J7.009B CH$LINK: PUBCHEM SID:7970 CH$LINK: INCHIKEY JTEJPPKMYBDEMY-UHFFFAOYSA-N
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 30 V
MS$FOCUSED_ION: PRECURSOR_M/Z 189 MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
PK$SPLASH: splash10-0006-1900000000-66f8cb9c260ecf410ce1 PK$NUM_PEAK: 7 PK$PEAK: m/z int. rel.int. 45.200 24752.5 29 58.800 133663.5 159 129.100 89109.0 106 143.400 49505.0 59 144.100 841585.0 999 156.100 103960.5 123 173.800 94059.5 112 //