MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003994
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003994
RECORD_TITLE: TRIMETHYLENEDIAMINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: TRIMETHYLENEDIAMINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C3H10N2
CH$EXACT_MASS: 74.08440
CH$SMILES: NCCCN
CH$IUPAC: InChI=1S/C3H10N2/c4-2-1-3-5/h1-5H2
CH$LINK: INCHIKEY
XFNJVJPLKCPIBV-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID1021906
AC$INSTRUMENT: HITACHI RMU-6L
AC$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$SPLASH: splash10-053r-9000000000-0a9fffbfecda98d5cee8
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
14 2 20
15 5 50
16 1.2 12
18 2.38 24
26 1.8 18
27 7.4 74
28 3.2 32
29 0.62 6
30 99.99 999
31 3.5 35
32 1.2 12
39 0.16 2
40 1 10
41 4.5 45
42 8.3 83
43 0.4 4
44 12.9 129
56 18.5 185
57 44.4 444
58 0.65 7
70 1.2 12
//
system version 2.2.6-SNAPSHOT