MassBank Record: JP003628

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

ACCESSION: JP003628
RECORD_TITLE: CHLOROBENZENE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: CHLOROBENZENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C6H5Cl CH$EXACT_MASS: 112.00798 CH$SMILES: Clc(c1)cccc1 CH$IUPAC: InChI=1S/C6H5Cl/c7-6-4-2-1-3-5-6/h1-5H CH$LINK: INCHIKEY MVPPADPHJFYWMZ-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID4020298
AC$INSTRUMENT: Unknown AC$INSTRUMENT_TYPE: EI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-03di-5900000000-0c50f1cf42286eb0397e PK$NUM_PEAK: 15 PK$PEAK: m/z int. rel.int. 37 2 20 38 5 50 50 9.3 93 51 1.2 12 55 4 40 73 2 20 74 4.5 45 75 0.5 5 76 3 30 77 45.2 452 78 3 30 112 99.99 999 113 7.2 72 114 33 330 115 2 20 //