MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011794
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011794
RECORD_TITLE: BORIC ACID TRIMETHYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: BORIC ACID TRIMETHYL ESTER
CH$NAME: TRIMETHYL BORATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C3H9BO3
CH$EXACT_MASS: 104.06447
CH$SMILES: CO[B](OC)OC
CH$IUPAC: InChI=1S/C3H9BO3/c1-5-4(6-2)7-3/h1-3H3
CH$LINK: INCHIKEY
WRECIMRULFAWHA-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID0037738
AC$INSTRUMENT: HITACHI M-80A
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: splash10-00fr-9000000000-4dfe09aa99b71dc3532e
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
13 1.59 16
14 14.31 143
15 54.53 545
16 4.42 44
27 3.06 31
28 2.83 28
29 79.11 791
30 9.47 95
31 16.79 168
39 1 10
40 2.73 27
41 5.14 51
42 18.7 187
43 47.72 477
44 3.26 33
45 6.86 69
55 1.11 11
56 9.44 94
57 38.14 381
58 13.08 131
59 28.64 286
71 5.46 55
72 43.41 434
73 99.99 999
74 2.62 26
86 2.75 28
87 10.54 105
88 4.64 46
89 14.28 143
102 1.06 11
103 11.85 119
104 31.64 316
105 1.69 17
//
system version 2.2.8-SNAPSHOT