MassBank Record: JP006132



 1,2,4-TRIMETHYLBENZENE; CI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP006132
RECORD_TITLE: 1,2,4-TRIMETHYLBENZENE; CI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: HASHIMOTO KKYOTO COLLEGE OF PHARMACY, KYOTO COLLEGE OF PHARMACY
LICENSE: CC BY-NC-SA

CH$NAME: 1,2,4-TRIMETHYLBENZENE CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H12 CH$EXACT_MASS: 120.09390 CH$SMILES: Cc(c1)cc(C)c(C)c1 CH$IUPAC: InChI=1S/C9H12/c1-7-4-5-8(2)9(3)6-7/h4-6H,1-3H3 CH$LINK: INCHIKEY GWHJZXXIDMPWGX-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID6021402
AC$INSTRUMENT: HITACHI M-80 AC$INSTRUMENT_TYPE: CI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 100 eV AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE
PK$SPLASH: splash10-00di-0900000000-ce7d4aadbd433a795e8c PK$NUM_PEAK: 13 PK$PEAK: m/z int. rel.int. 65 1.98 20 77 4.1 41 78 2.15 22 79 4.14 41 91 5.84 58 103 3.19 32 104 1.74 17 105 57.64 576 106 5.14 51 119 30.5 305 120 83.14 831 121 99.99 999 122 9.54 95 //

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