ACCESSION: MSBNK-MSSJ-MSJ00066
RECORD_TITLE: Triethanolamine; FAB-BE; MS; Positive; Matrix Triethanolamine
DATE: 2018.02.01
AUTHORS: Rika Miyake, Graduate School of Engineering Science, Osaka University
LICENSE: CC BY
COPYRIGHT: Rika Miyake, Graduate School of Engineering Science, Osaka University
COMMENT: This record was created by the financial support of MEXT/JSPS KAKENHI Grant Number 17HP8021 (2017) to the MassBank database committee of the Mass Spectrometry Society of Japan.
COMMENT: Sample was injected by flow injection

CH$NAME: Triethanolamine
CH$COMPOUND_CLASS: Non-Natural Product
CH$FORMULA: C₆H₁₅NO₃
CH$EXACT_MASS: 149.10519
CH$SMILES: OCCN(CCO)CCO
CH$IUPAC: InChI=1S/C6H15NO3/c8-4-1-7(2-5-9)3-6-10/h8-10H,1-6H2
CH$LINK: CHEMSPIDER 13835630
CH$LINK: INCHIKEY GSEJCLTVZPLZKY-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:7618
CH$LINK: COMPTOX DTXSID9021392

AC$INSTRUMENT: JMS-700, JEOL
AC$INSTRUMENT_TYPE: FAB-BE
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION FAB
AC$MASS_SPECTROMETRY: LASER Xe 6 keV
AC$MASS_SPECTROMETRY: MATRIX Triethanolamine
AC$MASS_SPECTROMETRY: RESOLUTION_SETTING 2000
AC$MASS_SPECTROMETRY: SCAN_RANGE_M/Z 1, 2000

PK$SPLASH: splash10-0udi-1900000000-9c3f02a6641c10ca7a3f
PK$NUM_PEAK: 68
PK$PEAK: m/z int. rel.int.
  27 29184 4
  28 39552 5
  29 16256 2
  30 87424 12
  41 27264 4
  42 131840 18
  43 29312 4
  44 178048 24
  45 358144 49
  56 251520 34
  57 35968 5
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  60 33152 5
  68 18944 3
  70 164096 22
  72 61696 8
  73 18688 3
  74 282240 38
  85 21888 3
  86 79488 11
  87 30848 4
  88 305536 42
  89 22272 3
  100 135936 18
  101 18560 3
  102 97664 13
  103 26496 4
  104 93056 13
  105 29952 4
  106 56064 8
  112 15360 2
  114 19584 3
  116 137600 19
  117 44416 6
  118 2756992 375
  119 163072 22
  120 37504 5
  130 138624 19
  131 105728 14
  132 628992 86
  133 48640 7
  134 16256 2
  144 17152 2
  146 89344 12
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  149 337792 46
  150 7348608 999
  151 520832 71
  152 58368 8
  160 16128 2
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  166 616960 84
  167 41856 6
  192 41088 6
  193 21632 3
  194 120192 16
  238 23296 3
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  300 41728 6
  315 44160 6
  448 25728 3
//