ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004396
RECORD_TITLE: 2,3-DIMETHYL-6-NITROPYRROLO(3,2-G)QUINOLINE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA
CH$NAME: 2,3-DIMETHYL-6-NITROPYRROLO(3,2-G)QUINOLINE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C13H11N3O2
CH$EXACT_MASS: 241.08513
CH$SMILES: CC1=C(NC2=C1C=C3C=C(C=NC3=C2)[N+](=O)[O-])C
CH$IUPAC: InChI=1S/C13H11N3O2/c1-7-8(2)15-13-5-12-9(4-11(7)13)3-10(6-14-12)16(17)18/h3-6,15H,1-2H3
CH$LINK: INCHIKEY DGTVXHLUWZSTMQ-UHFFFAOYSA-N
AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 50 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-0007-6790000000-2d18c5471c88680e2d44
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
  45 24 240
  55 26.1 261
  56 4.8 48
  57 2.12 21
  69 4.8 48
  71 13.1 131
  83 11.9 119
  97 1.19 12
  167 11.9 119
  168 13.1 131
  179 2.4 24
  180 0.48 5
  193 2.4 24
  194 3.6 36
  195 63 630
  196 0.48 5
  211 2.4 24
  226 2.4 24
  240 4.8 48
  241 99.99 999
  242 9.5 95
//
