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MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP012267

2-METHYL-1-PROPYLBENZENE; CI-B; MS

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

ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012267
RECORD_TITLE: 2-METHYL-1-PROPYLBENZENE; CI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: IIDA Y, DAISHIMA S, FAC. OF ENGINEERING, SEIKEI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 2-METHYL-1-PROPYLBENZENE
CH$NAME: 2-PROPYLTOLUENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H14
CH$EXACT_MASS: 134.10955
CH$SMILES: CCCc(c1)c(C)ccc1
CH$IUPAC: InChI=1S/C10H14/c1-3-6-10-8-5-4-7-9(10)2/h4-5,7-8H,3,6H2,1-2H3
CH$LINK: CAS 1074-17-5
CH$LINK: INCHIKEY YQZBFMJOASEONC-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4061466

AC$INSTRUMENT: FINNIGAN-MAT 4500
AC$INSTRUMENT_TYPE: CI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 120 eV
AC$MASS_SPECTROMETRY: REAGENT_GAS METHANE

PK$SPLASH: splash10-000i-1900000000-d0054cb7d77858a86763
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
  91 1.09 11
  93 21.84 218
  94 1.9 19
  105 4.42 44
  119 6.58 66
  121 7.22 72
  133 15.9 159
  134 8.56 86
  135 99.99 999
  136 11.05 111
  163 19.14 191
  164 2.58 26
  175 7.79 78
//

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