MassBank Record: KO003388



 Minoxidil; 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: KO003388
RECORD_TITLE: Minoxidil; LC-ESI-QQ; MS2; CE:20 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 M035

CH$NAME: Minoxidil CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H15N5O CH$EXACT_MASS: 209.12766 CH$SMILES: Nc(c1)n(=O)c(N)nc1N(C2)CCCC2 CH$IUPAC: InChI=1S/C9H15N5O/c10-7-6-8(12-9(11)14(7)15)13-4-2-1-3-5-13/h6H,1-5,10H2,(H2,11,12) CH$LINK: KEGG C07226 CH$LINK: INCHIKEY ZFMITUMMTDLWHR-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID9040685
AC$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$FOCUSED_ION: PRECURSOR_M/Z 210 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-03dl-0950000000-f76a21fbbfffb939b270 PK$NUM_PEAK: 68 PK$PEAK: m/z int. rel.int. 57.100 69307.0 1 59.100 623763.0 2 60.400 54455.5 1 69.100 39604.0 1 69.500 19802.0 1 73.100 44554.5 1 80.900 193069.5 1 83.000 326733.0 1 84.200 11128724.0 36 86.300 1618813.5 5 87.000 59406.0 1 89.200 960397.0 3 94.000 24752.5 1 95.900 39604.0 1 96.900 54455.5 1 97.100 34653.5 1 98.900 69307.0 1 100.200 1024753.5 3 102.200 34653.5 1 105.200 79208.0 1 107.300 113861.5 1 109.300 24752.5 1 110.100 17797047.5 58 111.200 4485153.0 15 112.100 128713.0 1 114.000 29703.0 1 116.300 29703.0 1 117.300 579208.5 2 119.800 84158.5 1 122.100 34653.5 1 123.200 232673.5 1 124.300 5905946.5 19 125.100 9851495.0 32 126.200 49505.0 1 127.300 64356.5 1 133.100 133663.5 1 135.400 94059.5 1 137.100 32316864.0 105 138.200 4544559.0 15 139.300 336634.0 1 141.100 529703.5 2 142.200 49505.0 1 146.900 143564.5 1 148.500 49505.0 1 150.200 13069320.0 42 151.300 7495057.0 24 152.300 1069308.0 3 153.500 24752.5 1 157.000 24752.5 1 161.300 59406.0 1 163.400 49505.0 1 164.300 39292118.5 127 165.200 6376244.0 21 166.300 2376240.0 8 168.100 2212873.5 7 174.100 74257.5 1 175.100 391089.5 1 176.100 4178222.0 14 177.500 925743.5 3 178.200 2945547.5 10 181.200 2554458.0 8 182.500 133663.5 1 192.400 4861391.0 16 193.500 308396348.0 999 208.000 19802.0 1 208.900 19802.0 1 210.200 276247801.0 895 225.000 14851.5 1 //

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