ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002520
RECORD_TITLE: 3-METHOXYBUTYL 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

CH$NAME: 3-METHOXYBUTYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₇H₁₄O₃
CH$EXACT_MASS: 146.09429
CH$SMILES: COC(C)CCOC(C)=O
CH$IUPAC: InChI=1S/C7H14O3/c1-6(9-3)4-5-10-7(2)8/h6H,4-5H2,1-3H3
CH$LINK: INCHIKEY QMYGFTJCQFEDST-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID2052106

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 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0a4i-9000000000-f94b0dff7d9a80e8c7de
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
  15 7.2 72
  27 3.81 38
  28 2.13 21
  29 7.72 77
  31 7.48 75
  33 1.5 15
  39 2.47 25
  41 6.82 68
  42 2.15 22
  43 41.33 413
  44 1.24 12
  45 2.94 29
  55 8.7 87
  56 3.1 31
  57 1.14 11
  58 3.59 36
  59 99.99 999
  60 3.39 34
  61 2.27 23
  71 22.33 223
  72 2.5 25
  73 1.2 12
  85 2.09 21
  86 9.76 98
  87 1.27 13
  116 1.15 12
//