MassBank Record: JP001776



 EICOSANOIC ACID BUTYL ESTER; CI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP001776
RECORD_TITLE: EICOSANOIC ACID BUTYL ESTER; CI-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$NAME: EICOSANOIC ACID BUTYL ESTER CH$COMPOUND_CLASS: N/A CH$FORMULA: C24H48O2 CH$EXACT_MASS: 368.36543 CH$SMILES: CCCCCCCCCCCCCCCCCCCC(=O)OCCCC CH$IUPAC: InChI=1S/C24H48O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24(25)26-23-6-4-2/h3-23H2,1-2H3
AC$INSTRUMENT: Unknown AC$INSTRUMENT_TYPE: CI-B AC$MASS_SPECTROMETRY: MS_TYPE MS AC$MASS_SPECTROMETRY: ION_MODE POSITIVE AC$MASS_SPECTROMETRY: REAGENT_GAS ISOBUTANE
PK$SPLASH: splash10-014i-1009000000-cd099bf9b3d909cc3c00 PK$NUM_PEAK: 22 PK$PEAK: m/z int. rel.int. 65 3.71 37 66 0.7 7 67 2.49 25 70 0.16 2 71 1.73 17 73 7.91 79 79 0.85 9 81 1.38 14 83 1.39 14 85 1.86 19 91 0.33 3 265 5.28 53 293 1.46 15 295 3.13 31 311 1.66 17 312 1.55 16 313 32.65 327 314 6.48 65 367 10.49 105 369 99.99 999 370 23.17 232 371 3.34 33 //