MassBank Record: KO002986



 D-(+)-Galactosamine; 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: KO002986
RECORD_TITLE: D-(+)-Galactosamine; LC-ESI-QQ; MS2; CE:30 V; [M+H]+
DATE: 2016.01.19 (2007.07.07, 2012.10.22)
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 G046

CH$NAME: Galactosamine CH$NAME: D-Chondrosamine CH$NAME: 2-Amino-2-deoxy-D-galactose CH$NAME: D-Galactosamine CH$NAME: D-(+)-Galactosamine CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H13NO5 CH$EXACT_MASS: 179.07937 CH$SMILES: OCC(O1)C(O)C(O)C(N)C(O)1 CH$IUPAC: InChI=1S/C6H13NO5/c7-3-5(10)4(9)2(1-8)12-6(3)11/h2-6,8-11H,1,7H2/t2-,3-,4+,5-,6?/m1/s1 CH$LINK: CAS 7535-00-4 CH$LINK: CHEBI 28328 CH$LINK: KEGG C02262 CH$LINK: NIKKAJI J16.141A CH$LINK: PUBCHEM SID:5324 CH$LINK: INCHIKEY MSWZFWKMSRAUBD-GASJEMHNSA-N CH$LINK: COMPTOX DTXSID7043871
AC$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 30 V
MS$FOCUSED_ION: PRECURSOR_M/Z 180 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-00di-9000000000-2d0c3fca6d602d08ee38 PK$NUM_PEAK: 60 PK$PEAK: m/z int. rel.int. 41.300 94059.5 8 42.000 29703.0 3 43.000 84158.5 7 44.100 1069308.0 94 45.000 1851487.0 162 46.200 188119.0 16 54.200 19802.0 2 55.100 386139.0 34 57.100 1029704.0 90 58.300 84158.5 7 59.100 173267.5 15 60.000 405941.0 36 61.100 292079.5 26 62.800 74257.5 6 68.200 376238.0 33 69.000 762377.0 67 70.100 846535.5 74 71.100 54455.5 5 72.000 11420803.5 999 73.200 193069.5 17 80.000 772278.0 68 80.800 346535.0 30 82.100 69307.0 6 83.400 103960.5 9 84.000 925743.5 81 85.100 688119.5 60 89.200 569307.5 50 90.300 44554.5 4 94.200 19802.0 2 94.900 29703.0 3 96.100 3366340.0 294 97.100 371287.5 32 98.100 960397.0 84 99.000 34653.5 3 100.000 108911.0 10 101.900 64356.5 6 102.400 34653.5 3 105.000 54455.5 5 106.900 84158.5 7 108.200 222772.5 19 109.200 188119.0 16 113.800 49505.0 4 115.700 24752.5 2 116.400 118812.0 10 117.000 94059.5 8 119.900 44554.5 4 125.900 267327.0 23 127.300 64356.5 6 127.800 108911.0 10 128.900 59406.0 5 130.000 113861.5 10 144.300 44554.5 4 145.200 69307.0 6 146.300 94059.5 8 147.000 49505.0 4 148.400 237624.0 21 162.100 89109.0 8 163.100 49505.0 4 165.100 24752.5 2 180.400 69307.0 6 //

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