MassBank Record: MSBNK-MSSJ-MSJ00066
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
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//
system version 2.2.6-SNAPSHOT