MassBank Record: JP000437



 3-ACETYLINDOLE; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000437
RECORD_TITLE: 3-ACETYLINDOLE; 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$NAME: 3-ACETYLINDOLE CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H9NO CH$EXACT_MASS: 159.06841 CH$SMILES: CC(=O)c(c1)c(c2)c(ccc2)n1 CH$IUPAC: InChI=1S/C10H9NO/c1-7(12)9-6-11-10-5-3-2-4-8(9)10/h2-6,11H,1H3
AC$INSTRUMENT: MX-1303 AC$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$SPLASH: splash10-0006-5900000000-195a438d220710d23987 PK$NUM_PEAK: 25 PK$PEAK: m/z int. rel.int. 39 3 30 41 2.6 26 43 10.5 105 44 0.2 2 45 6.3 63 55 2.3 23 57 2.8 28 60 0.16 2 62 1.5 15 63 6.5 65 69 7 70 71 0.11 1 72 1.2 12 77 2.2 22 81 1.6 16 88 0.13 1 89 18.8 188 90 1.2 12 115 2.3 23 116 1.33 13 130 2.3 23 144 99.99 999 145 7 70 159 4.37 44 160 2.1 21 //