MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009789

ETHYL 2-PYRROLIDONYLACETATE; EI-B; MS

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ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009789
RECORD_TITLE: ETHYL 2-PYRROLIDONYLACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA

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CH$NAME: ETHYL 2-PYRROLIDONYLACETATE
CH$NAME: N-ETHOXYCARBONYLMETHYL-2-PYRROLIDONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₈H₁₃NO₃
CH$EXACT_MASS: 171.08954
CH$SMILES: CCOC(=O)CN(C1)C(=O)CC1
CH$IUPAC: InChI=1S/C8H13NO3/c1-2-12-8(11)6-9-5-3-4-7(9)10/h2-6H2,1H3
CH$LINK: INCHIKEY AQZWKPDVWWJWRY-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID7057785

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AC$INSTRUMENT: JEOL JMS-D-300
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

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MS$FOCUSED_ION: ION_TYPE [M]+*

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PK$SPLASH: splash10-0002-9100000000-7143ea5aad2a73df86f0
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
  27 3.2 32
  28 5.8 58
  29 3.1 31
  30 0.12 1
  39 2.3 23
  41 11.8 118
  42 8.8 88
  43 0.42 4
  68 3.4 34
  69 11.2 112
  70 27.6 276
  71 0.15 2
  84 17.1 171
  97 1.2 12
  98 99.99 999
  99 0.68 7
  126 4.8 48
  171 21.4 214
  172 2.2 22
//