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MassBank Record: MSBNK-EPA-ENTACT_AGILENT000664

N'-[3-(Dimethylamino)propyl]-N,N-dimethylpropane-1,3-diamine; ESI-QTOF; MS2; CE: 10; [M+H]+

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT000664
RECORD_TITLE: N'-[3-(Dimethylamino)propyl]-N,N-dimethylpropane-1,3-diamine; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: N'-[3-(Dimethylamino)propyl]-N,N-dimethylpropane-1,3-diamine
CH$NAME: DTXSID7044974
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H25N3
CH$EXACT_MASS: 187.2048478197
CH$SMILES: CN(C)CCCNCCCN(C)C
CH$IUPAC: InChI=1S/C10H25N3/c1-12(2)9-5-7-11-8-6-10-13(3)4/h11H,5-10H2,1-4H3
CH$LINK: CAS 6711-48-4
CH$LINK: INCHIKEY BXYVQNNEFZOBOZ-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:81207

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 10

MS$FOCUSED_ION: PRECURSOR_M/Z 188.2121242714
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-000i-8900000000-148b7119c1e1bee17219
PK$NUM_PEAK: 5
PK$PEAK: m/z int. rel.int.
  58.065126 8.926064 89
  86.096426 92.924433 928
  98.096426 11.195848 111
  143.154275 23.461732 234
  188.212124 100.000002 999
//

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Funded by the Deutsche Forschungsgemeinschaft (DFG, German Research Foundation) under the National Research Data Infrastructure – NFDI4Chem – Projektnummer 441958208.

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