MassBank Record: JP001772



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

ACCESSION: JP001772
RECORD_TITLE: HEXADECANOIC 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$NAME: HEXADECANOIC ACID BUTYL ESTER CH$COMPOUND_CLASS: N/A CH$FORMULA: C20H40O2 CH$EXACT_MASS: 312.30283 CH$SMILES: CCCCCCCCCCCCCCCC(=O)OCCCC CH$IUPAC: InChI=1S/C20H40O2/c1-3-5-7-8-9-10-11-12-13-14-15-16-17-18-20(21)22-19-6-4-2/h3-19H2,1-2H3
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: splash10-03k9-9007000000-d61b1e39a8fbd1e11443 PK$NUM_PEAK: 10 PK$PEAK: m/z int. rel.int. 65 28.16 282 67 10.73 107 73 67.22 672 79 6.03 60 81 8.36 84 85 12.36 124 91 6.51 65 257 13.81 138 313 99.99 999 314 20.32 203 //