MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004117
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004117
RECORD_TITLE: N,N-DIMETHYLBENZYLAMINE; 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$NAME: N,N-DIMETHYLBENZYLAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H13N
CH$EXACT_MASS: 135.10480
CH$SMILES: CN(C)Cc(c1)cccc1
CH$IUPAC: InChI=1S/C9H13N/c1-10(2)8-9-6-4-3-5-7-9/h3-7H,8H2,1-2H3
CH$LINK: INCHIKEY
XXBDWLFCJWSEKW-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID8021854
AC$INSTRUMENT: HITACHI M-68
AC$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$SPLASH: splash10-052o-9500000000-5ee951185ebe90ca6564
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
15 4.9 49
27 2.2 22
28 3.6 36
29 1.4 14
30 3.1 31
31 1.6 16
38 1.7 17
39 0.93 9
40 1.4 14
41 3.9 39
42 21.5 215
43 0.41 4
44 10.1 101
50 3.2 32
51 8.2 82
52 0.18 2
57 3.9 39
58 99.99 999
59 3.5 35
62 0.22 2
63 5.9 59
64 2 20
65 18.6 186
66 0.13 1
77 4.9 49
78 1.8 18
89 5.4 54
90 0.23 2
91 67.7 677
92 11.8 118
118 5 50
132 0.27 3
134 55.1 551
135 96 960
136 9.7 97
//
system version 2.2.4-SNAPSHOT