MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP005861
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP005861
RECORD_TITLE: 4-PIPECOLINE; 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$NAME: 4-PIPECOLINE
CH$NAME: 4-METHYLPIPERIDINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H13N
CH$EXACT_MASS: 99.10480
CH$SMILES: CC(C1)CCNC1
CH$IUPAC: InChI=1S/C6H13N/c1-6-2-4-7-5-3-6/h6-7H,2-5H2,1H3
CH$LINK: INCHIKEY
UZOFELREXGAFOI-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID8060820
AC$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: splash10-0535-9000000000-5ce0aa47572df9a11a8b
PK$NUM_PEAK: 35
PK$PEAK: m/z int. rel.int.
15 4.2 42
26 2.25 23
27 17.97 180
28 29 290
29 22.75 228
30 57.91 579
38 1.76 18
39 14.55 146
40 2.54 25
41 21.68 217
42 36.23 362
43 31.35 314
44 56.25 563
45 1.76 18
50 1.17 12
51 1.86 19
52 1.37 14
53 3.81 38
54 2.93 29
55 17.09 171
56 68.46 685
57 48.73 487
58 2.34 23
67 2.25 23
68 2.54 25
69 3.61 36
70 7.52 75
71 5.08 51
80 1.76 18
82 2.73 27
84 24.61 246
85 1.37 14
98 99.99 999
99 58.89 589
100 4.1 41
//