MassBank Record: JP006889

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EICOSANE; EI-B; MS
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n
metabolomics-usi visualisation

ACCESSION: JP006889
RECORD_TITLE: EICOSANE; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: EICOSANE CH$NAME: ICOSANE CH$COMPOUND_CLASS: N/A CH$FORMULA: C20H42 CH$EXACT_MASS: 282.32865 CH$SMILES: CCCCCCCCCCCCCCCCCCCC CH$IUPAC: InChI=1S/C20H42/c1-3-5-7-9-11-13-15-17-19-20-18-16-14-12-10-8-6-4-2/h3-20H2,1-2H3 CH$LINK: INCHIKEY CBFCDTFDPHXCNY-UHFFFAOYSA-N CH$LINK: COMPTOX DTXSID1025227
AC$INSTRUMENT: HITACHI M-80B 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: splash10-0a4l-9000000000-e134070d5bd2cd5dee70 PK$NUM_PEAK: 39 PK$PEAK: m/z int. rel.int. 27 7.18 72 29 20.22 202 39 4.11 41 41 40.1 401 42 9.9 99 43 90.26 903 44 2.2 22 53 1.55 16 54 2.16 22 55 26.74 267 56 16.13 161 57 99.99 999 58 4.55 46 67 1.93 19 68 1.75 18 69 11.46 115 70 11.06 111 71 58.74 587 72 2.22 22 82 1.3 13 83 6.77 68 84 5.85 59 85 37.11 371 86 1.94 19 97 4.16 42 98 4.03 40 99 9.92 99 111 1.52 15 112 2.1 21 113 5.67 57 126 1.86 19 127 3.89 39 140 1.23 12 141 2.24 22 154 1.07 11 155 1.6 16 169 1.43 14 183 1.22 12 282 1.52 15 //