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MassBank Record: MSBNK-EPA-ENTACT_AGILENT000877

N,N-Bis(2-hydroxyethyl)formamide; ESI-QTOF; MS2; CE: 40; [M+H]+

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT000877
RECORD_TITLE: N,N-Bis(2-hydroxyethyl)formamide; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: N,N-Bis(2-hydroxyethyl)formamide
CH$NAME: DTXSID3044625
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C5H11NO3
CH$EXACT_MASS: 133.0738932252
CH$SMILES: OCCN(CCO)C=O
CH$IUPAC: InChI=1S/C5H11NO3/c7-3-1-6(5-9)2-4-8/h5,7-8H,1-4H2
CH$LINK: CAS 25209-66-9
CH$LINK: INCHIKEY AGQSGSYOSSBGLI-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:91333

AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40

MS$FOCUSED_ION: PRECURSOR_M/Z 134.0811696769
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0007-9000000000-82eac68e6cf2c4277070
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  28.018175 1.011492 10
  29.002191 2.043104 20
  39.022927 1.843289 18
  41.038577 12.42186 124
  42.033826 38.169407 381
  43.017841 9.592319 95
  43.054227 3.80828 38
  44.049476 100 999
  44.083181 1.248553 12
  45.033491 95.451237 953
  45.057301 1.917008 19
  45.069877 1.187306 11
  54.031145 1.308645 13
  55.041651 8.855303 88
  56.049476 1.706914 17
  58.065126 1.040553 10
  68.049476 1.257517 12
  70.065126 5.662754 56
  72.04439 4.043464 40
//

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