ACCESSION: MSBNK-EPA-ENTACT_AGILENT000913
RECORD_TITLE: 2-Amino-N-cyclohexyl-N-methylbenzenesulfonamide; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: 2-Amino-N-cyclohexyl-N-methylbenzenesulfonamide
CH$NAME: DTXSID1044982
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₃H₂₀N₂O₂S
CH$EXACT_MASS: 268.1245486274
CH$SMILES: CN(C1CCCCC1)S(=O)(=O)C1=CC=CC=C1N
CH$IUPAC: InChI=1S/C13H20N2O2S/c1-15(11-7-3-2-4-8-11)18(16,17)13-10-6-5-9-12(13)14/h5-6,9-11H,2-4,7-8,14H2,1H3
CH$LINK: CAS 70693-59-3
CH$LINK: INCHIKEY IPEHSCPRVOWQFQ-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:116814

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$FOCUSED_ION: PRECURSOR_M/Z 269.1318250791
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0a4l-7900000000-f25b3d5f14cddc046e1c
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  55.054227 13.341536 133
  65.038577 2.51351 25
  83.085527 16.332297 163
  92.049476 81.398399 813
  92.086552 1.331541 13
  108.04439 20.98059 209
  156.011376 99.999998 999
  156.056966 1.847497 18
  187.053575 11.223702 112
//