MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007574

TERPINYL ACETATE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007574
RECORD_TITLE: TERPINYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAKEUCHI T, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

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CH$NAME: TERPINYL ACETATE
CH$NAME: ACETIC ACID PARA-MENTH-1-EN-8-OL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₂H₂₀O₂
CH$EXACT_MASS: 196.14633
CH$SMILES: CC(=O)OC(C)(C)C(C1)CCC(=C)C1
CH$IUPAC: InChI=1S/C12H20O2/c1-9-5-7-11(8-6-9)12(3,4)14-10(2)13/h11H,1,5-8H2,2-4H3
CH$LINK: CAS 8007-35-0
CH$LINK: INCHIKEY IWKXKWUCSZHJEK-UHFFFAOYSA-N

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AC$INSTRUMENT: HITACHI M-80
AC$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$SPLASH: splash10-00rf-9600000000-87aa6500b5f415c4625c
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
  59 24.39 244
  60 5.36 54
  68 63.64 636
  69 47.29 473
  80 23.91 239
  81 26.5 265
  92 37.8 378
  93 97.59 976
  107 28.31 283
  108 19.64 196
  121 92.39 924
  122 14.88 149
  136 68.37 684
  137 22.18 222
//