MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP000477
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP000477
RECORD_TITLE: PYRIDINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA
CH$NAME: PYRIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H5N
CH$EXACT_MASS: 79.04220
CH$SMILES: c(c1)ccnc1
CH$IUPAC: InChI=1S/C5H5N/c1-2-4-6-5-3-1/h1-5H
CH$LINK: INCHIKEY
JUJWROOIHBZHMG-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID9021924
AC$INSTRUMENT: MX-1303
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 50 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0ufr-9000000000-445aeb46f419295729de
PK$NUM_PEAK: 33
PK$PEAK: m/z int. rel.int.
29 31 310
30 12.3 123
31 5.9 59
34 0.24 2
36 2.9 29
37 4.2 42
38 6.2 62
39 1.49 15
40 46.9 469
41 7.9 79
42 6.5 65
43 1.51 15
45 5.5 55
46 2.1 21
48 2.4 24
49 0.6 6
50 35.2 352
51 39.1 391
52 75.5 755
53 1.06 11
55 5.2 52
56 2.6 26
57 2.3 23
60 0.23 2
64 3.3 33
67 2.4 24
69 2.3 23
75 0.26 3
76 2.4 24
77 2.3 23
78 12.7 127
79 99.99 999
80 6.5 65
//