MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP001514
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP001514
RECORD_TITLE: BENZYLAMINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: BENZYLAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H9N
CH$EXACT_MASS: 107.07350
CH$SMILES: NCc(c1)cccc1
CH$IUPAC: InChI=1S/C7H9N/c8-6-7-4-2-1-3-5-7/h1-5H,6,8H2
CH$LINK: COMPTOX
DTXSID5021839
CH$LINK: INCHIKEY
WGQKYBSKWIADBV-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:7504
AC$INSTRUMENT: HITACHI RMU-6M
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: splash10-0a6r-9600000000-76805d0c1bcba470e1e9
PK$NUM_PEAK: 38
PK$PEAK: m/z int. rel.int.
26 1.03 10
27 4.1 41
28 29.18 292
29 6.53 65
30 39.55 396
37 1.44 14
38 2.66 27
39 9.5 95
40 1.03 10
41 1.73 17
49 1.08 11
50 9.32 93
51 18.27 183
52 6.79 68
52.5 3.41 34
53 4.93 49
53.5 1.76 18
54 1.44 14
61 1.03 10
62 2.06 21
63 4.9 49
64 1.47 15
65 6.3 63
74 2.51 25
75 1.81 18
76 2.27 23
77 23.94 239
78 15.69 157
79 43.52 435
89 4.1 41
90 2.4 24
91 15.2 152
92 1.6 16
104 4.91 49
105 2.09 21
106 99.99 999
107 69.82 698
108 5.73 57
//
system version 2.2.6-SNAPSHOT