ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007565
RECORD_TITLE: PARA-CYMENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAKEUCHI T, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: PARA-CYMENE
CH$NAME: 1-METHYL-4-(1-METHYLETHYL)BENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₄
CH$EXACT_MASS: 134.10955
CH$SMILES: CC(C)c(c1)ccc(C)c1
CH$IUPAC: InChI=1S/C10H14/c1-8(2)10-6-4-9(3)5-7-10/h4-8H,1-3H3
CH$LINK: INCHIKEY HFPZCAJZSCWRBC-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID3026645

AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-001i-0900000000-146f5d56238ffde0a8d0
PK$NUM_PEAK: 3
PK$PEAK: m/z int. rel.int.
  120 9.92 99
  134 33.05 331
  135 3.01 30
//