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MassBank Record: JP002876

GAMMA-HEXALACTONE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: JP002876
RECORD_TITLE: GAMMA-HEXALACTONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA

CH$NAME: GAMMA-HEXALACTONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H10O2
CH$EXACT_MASS: 114.06808
CH$SMILES: CCC(C1)OC(=O)C1
CH$IUPAC: InChI=1S/C6H10O2/c1-2-5-3-4-6(7)8-5/h5H,2-4H2,1H3
CH$LINK: INCHIKEY JBFHTYHTHYHCDJ-UHFFFAOYSA-N
CH$LINK: COMPTOX DTXSID8041298

AC$INSTRUMENT: Unknown
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0570-9000000000-33d7bffec7b90b244b58
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
  15 2.86 29
  26 5.01 50
  27 21.43 214
  28 31.33 313
  29 96.43 964
  30 3.83 38
  31 2.65 27
  38 2.72 27
  39 9.32 93
  40 2.16 22
  41 10.88 109
  42 23.87 239
  43 3.75 38
  55 15.11 151
  56 39.94 399
  57 38.85 389
  58 3.82 38
  59 4.07 41
  70 16.84 168
  85 99.99 999
  86 10.87 109
  114 2.61 26
//

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