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MassBank Record: MSBNK-EPA-ENTACT_AGILENT000545

N-Cyclohexyl-N-methylcyclohexanamine; ESI-QTOF; MS2; CE: 20; [M+H]+

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT000545
RECORD_TITLE: N-Cyclohexyl-N-methylcyclohexanamine; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: N-Cyclohexyl-N-methylcyclohexanamine
CH$NAME: DTXSID6044727
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H25N
CH$EXACT_MASS: 195.1986998049
CH$SMILES: CN(C1CCCCC1)C1CCCCC1
CH$IUPAC: InChI=1S/C13H25N/c1-14(12-8-4-2-5-9-12)13-10-6-3-7-11-13/h12-13H,2-11H2,1H3
CH$LINK: CAS 7560-83-0
CH$LINK: INCHIKEY GSCCALZHGUWNJW-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:24210

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 20

MS$FOCUSED_ION: PRECURSOR_M/Z 196.2059762566
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-06sj-8900000000-41c7e949e2ea03cbffe3
PK$NUM_PEAK: 8
PK$PEAK: m/z int. rel.int.
  32.049476 20.394903 203
  41.038577 1.383568 13
  55.054227 70.055785 699
  83.085527 92.026535 919
  98.096426 1.631947 16
  112.112076 4.061964 40
  114.127726 100 999
  196.205976 99.528022 994
//

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