MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP012327

INDENE; CI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012327
RECORD_TITLE: INDENE; 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

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CH$NAME: INDENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₉H₈
CH$EXACT_MASS: 116.06260
CH$SMILES: c(c2)cc(C1)c(c2)C=C1
CH$IUPAC: InChI=1S/C9H8/c1-2-5-9-7-3-6-8(9)4-1/h1-6H,7H2
CH$LINK: CAS 95-13-6
CH$LINK: INCHIKEY YBYIRNPNPLQARY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8042052

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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

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PK$SPLASH: splash10-014i-0900000000-5e39117c9fb509449824
PK$NUM_PEAK: 8
PK$PEAK: m/z int. rel.int.
  115 1.6 16
  116 8.7 87
  117 99.99 999
  118 10.77 108
  129 1.21 12
  145 25.06 251
  146 3.05 31
  157 5.58 56
//