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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002006

2-ISOPROPYL-1-PYRROLINE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002006
RECORD_TITLE: 2-ISOPROPYL-1-PYRROLINE; 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$NAME: 2-ISOPROPYL-1-PYRROLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H13N
CH$EXACT_MASS: 111.10480
CH$SMILES: CC(C)C(C1)=NCC1
CH$IUPAC: InChI=1S/C7H13N/c1-6(2)7-4-3-5-8-7/h6H,3-5H2,1-2H3
CH$LINK: INCHIKEY QHOFHBIBSFDMDJ-UHFFFAOYSA-N

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$SPLASH: splash10-000y-9000000000-9222b92cc204bc7fc025
PK$NUM_PEAK: 54
PK$PEAK: m/z int. rel.int.
  26 2.8 28
  27 15.7 157
  29 2.3 23
  30 0.38 4
  31 5.6 56
  38 2.3 23
  39 22.7 227
  40 0.8 8
  41 72.7 727
  42 24.4 244
  43 29.2 292
  45 0.35 4
  50 1.4 14
  51 3 30
  52 3.5 35
  53 0.6 6
  54 11.9 119
  55 12.8 128
  56 6.5 65
  57 0.15 2
  58 1.1 11
  59 2.8 28
  65 2.7 27
  66 0.19 2
  67 2.4 24
  68 2.5 25
  69 2.6 26
  70 0.18 2
  71 1.5 15
  74 2.1 21
  77 2.7 27
  78 0.14 1
  79 3.5 35
  80 5.8 58
  81 7 70
  82 1.36 14
  83 77.3 773
  84 5.6 56
  87 1.5 15
  91 0.16 2
  92 1.1 11
  93 2 20
  94 5.3 53
  95 0.17 2
  96 99.99 999
  97 8.6 86
  98 1.2 12
  106 0.32 3
  107 2.1 21
  108 7.2 72
  109 3.2 32
  110 1.61 16
  111 8.6 86
  112 1.4 14
//

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