MassBank Record: MCH00003

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9-Aminoacridine; MALDI-TOF; MS; Pos

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

ACCESSION: MCH00003
RECORD_TITLE: 9-Aminoacridine; MALDI-TOF; MS; Pos
DATE: 2016.01.19 (Created 2010.10.06, modified 2011.05.11)
AUTHORS: Wada Y, Osaka Medical Center for Maternal and Child Health
LICENSE: CC BY-SA
COMMENT: Profile spectrum of this record is given as a JPEG file.
COMMENT: [Profile] MCH00003.jpg

CH$NAME: 9-Aminoacridine
CH$NAME: 9-AA
CH$COMPOUND_CLASS: Non-Natural Product
CH$FORMULA: C13H10N2
CH$EXACT_MASS: 194.08440
CH$SMILES: Nc(c21)c(c3)c(ccc3)nc(cccc2)1
CH$IUPAC: InChI=1S/C13H10N2/c14-13-9-5-1-3-7-11(9)15-12-8-4-2-6-10(12)13/h1-8H,(H2,14,15)
CH$LINK: INCHIKEY XJGFWWJLMVZSIG-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2024456
CH$LINK: PUBCHEM CID:7019

AC$INSTRUMENT: Voyager DE-PRO, Applied Biosystems
AC$INSTRUMENT_TYPE: MALDI-TOF
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: LASER UV 337 nm nitrogen lazer, 20 Hz, 10 nsec
AC$MASS_SPECTROMETRY: SAMPLE_DRIPPING saturated
AC$CHROMATOGRAPHY: SOLVENT A:B = 60:40 (A=isopropanol, B=acetonitrile)

PK$SPLASH: splash10-0002-0900000000-9da722f17c689dba3176
PK$ANNOTATION: m/z ion
  195.09 [M+H]+
PK$NUM_PEAK: 2
PK$PEAK: m/z int. rel.int.
  195.09167 94804 999
  196.095033 15478 163
//