ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012328
RECORD_TITLE: INDANE; 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$NAME: INDANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₁₀
CH$EXACT_MASS: 118.07825
CH$SMILES: c(c2)cc(C1)c(c2)CC1
CH$IUPAC: InChI=1S/C9H10/c1-2-5-9-7-3-6-8(9)4-1/h1-2,4-5H,3,6-7H2
CH$LINK: CAS 496-11-7
CH$LINK: INCHIKEY PQNFLJBBNBOBRQ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID4052132

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$SPLASH: splash10-014i-0900000000-c4f25413e43c418a8a15
PK$NUM_PEAK: 7
PK$PEAK: m/z int. rel.int.
  117 17.2 172
  118 9.25 93
  119 99.99 999
  120 10.91 109
  147 22.59 226
  148 1.27 13
  159 5.72 57
//