MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP012251
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012251
RECORD_TITLE: 1-PROPENYLBENZENE; 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$NAME: 1-PROPENYLBENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H10
CH$EXACT_MASS: 118.07825
CH$SMILES: CC=Cc(c1)cccc1
CH$IUPAC: InChI=1S/C9H10/c1-2-6-9-7-4-3-5-8-9/h2-8H,1H3/b6-2+
CH$LINK: CAS
637-50-3
CH$LINK: INCHIKEY
QROGIFZRVHSFLM-QHHAFSJGSA-N
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$SPLASH: splash10-014i-1900000000-eeed613e8155df521946
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
91 29.35 294
92 2.14 21
105 3.6 36
117 4.41 44
118 7.23 72
119 99.99 999
120 10.15 102
147 17.96 180
148 2.57 26
159 3.06 31
//