MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005292
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005292
RECORD_TITLE: GAMMA-PICOLINE; 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$NAME: GAMMA-PICOLINE
CH$NAME: 4-METHYLPYRIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H7N
CH$EXACT_MASS: 93.05785
CH$SMILES: Cc(c1)ccnc1
CH$IUPAC: InChI=1S/C6H7N/c1-6-2-4-7-5-3-6/h2-5H,1H3
CH$LINK: INCHIKEY
FKNQCJSGGFJEIZ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4021892
AC$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: splash10-0006-9000000000-75f1d52abf95872b6e73
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
26 3.22 32
27 3.72 37
28 4 40
37 3.1 31
38 6.38 64
39 22.99 230
40 10.44 104
41 3.55 36
49 1.17 12
50 5.32 53
51 8.6 86
52 4.16 42
53 5.61 56
54 7.6 76
61 1.72 17
62 2.66 27
63 5.83 58
64 3.05 31
65 18.88 189
66 36.15 362
67 8.38 84
78 4.22 42
91 1.39 14
92 21.77 218
93 99.99 999
94 7.72 77
//
system version 2.2.6-SNAPSHOT