MassBank Record: KO003166



 Methenamine; LC-ESI-QQ; MS2; CE:50 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO003166
RECORD_TITLE: Methenamine; LC-ESI-QQ; MS2; CE:50 V; [M+H]+
DATE: 2016.01.19 (Created 2007.07.07, modified 2011.05.10)
AUTHORS: Kakazu Y, Horai H, Institute for Advanced Biosciences, Keio Univ.
LICENSE: CC BY-NC-SA
COMMENT: KEIO_ID H112

CH$NAME: Hexamethylene tetramine CH$NAME: Methenamine CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H12N4 CH$EXACT_MASS: 140.10620 CH$SMILES: C(N23)N(C1)CN(C3)CN(C2)1 CH$IUPAC: InChI=1S/C6H12N4/c1-7-2-9-4-8(1)5-10(3-7)6-9/h1-6H2 CH$LINK: KEGG C07176
AC$INSTRUMENT: API3000, Applied Biosystems AC$INSTRUMENT_TYPE: LC-ESI-QQ AC$MASS_SPECTROMETRY: MS_TYPE MS2 AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: COLLISION_ENERGY 50 V
MS$FOCUSED_ION: PRECURSOR_M/Z 141 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-004l-9000000000-371b89c99afba4931848 PK$NUM_PEAK: 8 PK$PEAK: m/z int. rel.int. 42.200 2851488.0 662 44.100 232673.5 54 51.100 425743.0 99 56.500 9901.0 2 58.300 34653.5 8 70.900 39604.0 9 78.200 4301984.5 999 96.100 217822.0 51 //