MassBank Record: KO002149



 N-Acetylputrescine; 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: KO002149
RECORD_TITLE: N-Acetylputrescine; 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 A051

CH$NAME: N-Acetylputrescine CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H14N2O CH$EXACT_MASS: 130.11061 CH$SMILES: NCCCCNC(C)=O CH$IUPAC: InChI=1S/C6H14N2O/c1-6(9)8-5-3-2-4-7/h2-5,7H2,1H3,(H,8,9) CH$LINK: CAS 18233-70-0 CH$LINK: CHEBI 17768 CH$LINK: KEGG C02714 CH$LINK: PUBCHEM SID:5677
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 131 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0229-9700000000-128ded2b5a97118c2d5d PK$NUM_PEAK: 26 PK$PEAK: m/z int. rel.int. 30.300 103960.5 1 40.600 69307.0 1 43.100 391089.5 3 55.300 1094060.5 9 57.400 9901.0 1 60.100 2257428.0 18 67.900 356436.0 3 69.100 89109.0 1 71.500 1584160.0 13 72.000 125990225.0 999 73.700 143564.5 1 77.400 34653.5 1 79.000 69307.0 1 81.000 148515.0 1 86.000 84158.5 1 89.200 267327.0 2 89.800 34653.5 1 96.000 168317.0 1 96.800 59406.0 1 98.800 29703.0 1 100.300 24752.5 1 113.000 34653.5 1 114.200 104990204.0 832 131.200 6232679.5 49 136.300 19802.0 1 297.300 19802.0 1 //