MassBank Record: KO003163



 Methenamine; LC-ESI-QQ; MS2; CE:20 V; [M+H]+ 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: KO003163
RECORD_TITLE: Methenamine; LC-ESI-QQ; MS2; CE:20 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$MASS_SPECTROMETRY: COLLISION_ENERGY 20 V
MS$FOCUSED_ION: PRECURSOR_M/Z 141 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-01ox-2900000000-86fe33e31cc8f7108c14 PK$NUM_PEAK: 17 PK$PEAK: m/z int. rel.int. 42.100 222772.5 5 44.200 202970.5 5 58.100 267327.0 6 60.000 64356.5 2 69.100 163366.5 4 71.000 3188122.0 75 78.000 4034657.5 95 81.000 49505.0 1 83.200 74257.5 2 85.100 8415850.0 198 96.000 3009904.0 71 98.100 7113868.5 167 105.500 257426.0 6 106.000 13945558.5 328 112.100 31955477.5 752 124.100 10094069.5 237 141.200 42465389.0 999 //