ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012357
RECORD_TITLE: NAPHTHACENE; 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$NAME: NAPHTHACENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₈H₁₂
CH$EXACT_MASS: 228.09390
CH$SMILES: c(c4)cc(c1)c(c4)cc(c2)c(cc(c3)c(ccc3)2)1
CH$IUPAC: InChI=1S/C18H12/c1-2-6-14-10-18-12-16-8-4-3-7-15(16)11-17(18)9-13(14)5-1/h1-12H
CH$LINK: CAS 92-24-0
CH$LINK: INCHIKEY IFLREYGFSNHWGE-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4059045

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$SPLASH: splash10-004i-0090000000-6261df50d44810e97296
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
  107 3.23 32
  228 39.19 392
  229 99.99 999
  230 19.59 196
  231 9.33 93
  232 1.62 16
  257 12.84 128
  258 2.91 29
  259 2.21 22
  269 1.29 13
//