MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004208
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004208
RECORD_TITLE: TETRAPROPYLAMMONIUM IODIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: ISA K, DEPT. OF CHEM., FAC. OF EDUC., FUKUI UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: TETRAPROPYLAMMONIUM IODIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H28IN
CH$EXACT_MASS: 313.12664
CH$SMILES: CCC[N+](CCC)(CCC)CCC.[I-]
CH$IUPAC: InChI=1S/C12H28N.HI/c1-5-9-13(10-6-2,11-7-3)12-8-4;/h5-12H2,1-4H3;1H/q+1;/p-1
CH$LINK: INCHIKEY
GKXDJYKZFZVASJ-UHFFFAOYSA-M
CH$LINK: COMPTOX
DTXSID30883343
AC$INSTRUMENT: JEOL JMS-01-SG
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 15 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-03di-4900000000-5c91971e164a5108e1ba
PK$NUM_PEAK: 17
PK$PEAK: m/z int. rel.int.
43 48.21 482
70 1.48 15
72 17.86 179
86 9.11 91
98 0.3 3
100 0.93 9
114 99.99 999
115 11.96 120
127 2.5 25
128 1.48 15
142 3.04 30
143 8.57 86
144 1.7 17
170 17.5 175
186 16.07 161
254 0.03 0
312 0.06 1
//
system version 2.2.8-SNAPSHOT