MassBank Record: JP001823



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

ACCESSION: JP001823
RECORD_TITLE: LACTIC ACID BUTYL ESTER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA

CH$NAME: LACTIC ACID BUTYL ESTER CH$NAME: BUTYL 2-HYDROXYPROPANOATE CH$COMPOUND_CLASS: N/A CH$FORMULA: C7H14O3 CH$EXACT_MASS: 146.09429 CH$SMILES: CCCCOC(=O)C(C)O CH$IUPAC: InChI=1S/C7H14O3/c1-3-4-5-10-7(9)6(2)8/h6,8H,3-5H2,1-2H3
AC$INSTRUMENT: HITACHI RMU-7M 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: splash10-0002-9000000000-e4eacc0f272d55fc90b8 PK$NUM_PEAK: 21 PK$PEAK: m/z int. rel.int. 15 1 10 19 1.64 16 26 1.37 14 27 11.03 110 28 7.02 70 29 20.51 205 31 5.93 59 39 3.65 37 41 24.07 241 42 3.46 35 43 13.22 132 44 2.73 27 45 99.99 999 46 2.01 20 55 3.28 33 56 12.94 129 57 13.04 130 74 4.83 48 75 2.64 26 85 1.82 18 89 3.37 34 //