MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008264
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008264
RECORD_TITLE: N-BENZYLGLYCOLAMIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: UBE SCIENTIFIC ANALYSIS LABORATORY
LICENSE: CC BY-NC-SA
CH$NAME: N-BENZYLGLYCOLAMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H11NO2
CH$EXACT_MASS: 165.07898
CH$SMILES: OCC(=O)NCc(c1)cccc1
CH$IUPAC: InChI=1S/C9H11NO2/c11-7-9(12)10-6-8-4-2-1-3-5-8/h1-5,11H,6-7H2,(H,10,12)
CH$LINK: INCHIKEY
GUDMTEGDXVJZEE-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID10282572
AC$INSTRUMENT: HITACHI M-60
AC$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$SPLASH: splash10-0006-9300000000-62703b86aff5dce1f179
PK$NUM_PEAK: 31
PK$PEAK: m/z int. rel.int.
28 8.39 84
29 4.04 40
30 6.87 69
31 18.73 187
39 6.09 61
41 1.68 17
42 1.1 11
50 2.87 29
51 7.69 77
52 1.7 17
60 1.73 17
63 2.39 24
65 11.81 118
74 1.36 14
77 7.91 79
78 4.31 43
79 6.12 61
89 2.32 23
90 1.39 14
91 99.99 999
92 19.38 194
104 7.02 70
106 12.01 120
107 4.81 48
118 5.77 58
119 5.52 55
146 1.85 19
147 4.11 41
149 0.54 5
165 28.45 285
166 2.78 28
//
system version 2.2.8-SNAPSHOT