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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004536

METHYL 2-O-METHYLFUCOPYRANOSIDE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004536
RECORD_TITLE: METHYL 2-O-METHYLFUCOPYRANOSIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HAYASHI A, DEPT. OF CHEMISTRY, FAC. OF SCI. AND TECHNOLOGY, KINKI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: METHYL 2-O-METHYLFUCOPYRANOSIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H16O5
CH$EXACT_MASS: 192.09977
CH$SMILES: COC(O1)C(OC)C(O)C(O)C(C)1
CH$IUPAC: InChI=1S/C8H16O5/c1-4-5(9)6(10)7(11-2)8(12-3)13-4/h4-10H,1-3H3/t4-,5+,6+,7-,8+/m1/s1
CH$LINK: INCHIKEY ZIRPXMSHWUAJJI-HNEXDWKRSA-N

AC$INSTRUMENT: SHIMADZU LKB-9000B
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-05g0-9000000000-c1a6aab3399814688304
PK$NUM_PEAK: 49
PK$PEAK: m/z int. rel.int.
  41 24.5 245
  42 7.4 74
  43 19 190
  44 0.37 4
  45 36.7 367
  46 0.3 3
  47 1.5 15
  53 0.1 1
  54 0.6 6
  55 10.3 103
  56 3.3 33
  57 1.07 11
  58 39 390
  59 30.4 304
  60 1.8 18
  61 0.39 4
  68 7.3 73
  69 16.8 168
  70 4.4 44
  71 2.91 29
  72 6.6 66
  73 12.5 125
  74 99.99 999
  75 7.88 79
  76 2.7 27
  77 0.2 2
  83 1.7 17
  85 0.52 5
  86 0.3 3
  87 56.2 562
  88 22.5 225
  89 0.31 3
  97 1.2 12
  98 0.3 3
  99 3.9 39
  100 0.81 8
  101 15.9 159
  102 1.4 14
  105 0.3 3
  114 0.2 2
  115 1 10
  117 0.3 3
  128 2.3 23
  129 0.24 2
  130 3.1 31
  131 1 10
  160 1.4 14
  161 1.32 13
  162 1.2 12
//

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