MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008053

2-PHENYLETHYL ACETATE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008053
RECORD_TITLE: 2-PHENYLETHYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

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CH$NAME: 2-PHENYLETHYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₀H₁₂O₂
CH$EXACT_MASS: 164.08373
CH$SMILES: CC(=O)OCCc(c1)cccc1
CH$IUPAC: InChI=1S/C10H12O2/c1-9(11)12-8-7-10-5-3-2-4-6-10/h2-6H,7-8H2,1H3
CH$LINK: COMPTOX DTXSID7044506
CH$LINK: INCHIKEY MDHYEMXUFSJLGV-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:7654

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AC$INSTRUMENT: HITACHI RMU-6M
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0udi-4900000000-4c2bc6e2ddf9cc5d80cd
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
  43 42.64 426
  44 1.18 12
  73 1.18 12
  78 2.47 25
  91 8.59 86
  92 2.47 25
  103 2.58 26
  104 99.99 999
  105 10.74 107
//