ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012350
RECORD_TITLE: 2-METHYLPHENANTHRENE; 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$NAME: 2-METHYLPHENANTHRENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₅H₁₂
CH$EXACT_MASS: 192.09390
CH$SMILES: Cc(c3)cc(c1)c(c3)c(c2)c(ccc2)c1
CH$IUPAC: InChI=1S/C15H12/c1-11-6-9-15-13(10-11)8-7-12-4-2-3-5-14(12)15/h2-10H,1H3
CH$LINK: CAS 2531-84-2
CH$LINK: INCHIKEY KANLOADZXMMCQA-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID1025649

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$SPLASH: splash10-0006-0910000000-4d40c69dcd9497d12ad4
PK$NUM_PEAK: 8
PK$PEAK: m/z int. rel.int.
  191 3.56 36
  192 9.05 91
  193 99.99 999
  194 15.63 156
  195 1.21 12
  221 19.8 198
  222 3.6 36
  233 3.81 38
//