MassBank Record: KO002998



 D-(+)-Glucosamine; 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: KO002998
RECORD_TITLE: D-(+)-Glucosamine; 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 G051

CH$NAME: Glucosamine CH$NAME: D-Glucosamine CH$NAME: Chitosamine CH$NAME: 2-Amino-2-deoxy-D-glucose CH$NAME: D-(+)-Glucosamine CH$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$LINK: CAS 3416-24-8 CH$LINK: CHEBI 17315 CH$LINK: KEGG C00329 CH$LINK: NIKKAJI J10.582A CH$LINK: PUBCHEM SID:3623
AC$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$FOCUSED_ION: PRECURSOR_M/Z 180 MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0005-9000000000-87345e602c89eb5bd145 PK$NUM_PEAK: 23 PK$PEAK: m/z int. rel.int. 29.900 29703.0 44 41.100 128713.0 192 42.200 89109.0 133 43.100 118812.0 178 44.100 490099.5 733 45.200 420792.5 629 46.200 668317.5 999 53.300 54455.5 81 55.100 123762.5 185 56.300 287129.0 429 56.900 84158.5 126 58.300 59406.0 89 60.200 396040.0 592 67.400 69307.0 104 69.000 366337.0 548 70.100 84158.5 126 72.000 336634.0 503 78.100 59406.0 89 80.900 9901.0 15 83.900 74257.5 111 85.000 39604.0 59 95.800 19802.0 30 115.300 44554.5 67 //