MassBank Record: JP008906



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

ACCESSION: JP008906
RECORD_TITLE: VALERIC ACID; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: YAMAMOTO MDEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV., DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: VALERIC ACID CH$COMPOUND_CLASS: N/A CH$FORMULA: C5H10O2 CH$EXACT_MASS: 102.06808 CH$SMILES: CCCCC(O)=O CH$IUPAC: InChI=1S/C5H10O2/c1-2-3-4-5(6)7/h2-4H2,1H3,(H,6,7) CH$LINK: INCHIKEY NQPDZGIKBAWPEJ-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI RMU-6M 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: splash10-03fr-9000000000-5ef705125c3c70ad3df3 PK$NUM_PEAK: 28 PK$PEAK: m/z int. rel.int. 15 1.9 19 26 4.2 42 27 26.9 269 28 1.18 12 29 23.8 238 30 1.4 14 31 2.4 24 38 0.18 2 39 12.7 127 40 1.4 14 41 22 220 42 1.04 10 43 9.1 91 45 9.8 98 50 1.3 13 51 0.12 1 53 1.3 13 55 6.7 67 56 3.3 33 57 0.28 3 59 1.2 12 60 99.99 999 61 4.1 41 73 3.69 37 74 3.7 37 85 1.4 14 87 2.4 24 102 0.8 8 //