MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004536
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
//
system version 2.2.8-SNAPSHOT