MassBank Record: JP009202



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

ACCESSION: JP009202
RECORD_TITLE: UNDECANOIC ACID; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: , SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: UNDECANOIC ACID CH$COMPOUND_CLASS: N/A CH$FORMULA: C11H22O2 CH$EXACT_MASS: 186.16198 CH$SMILES: CCCCCCCCCCC(O)=O CH$IUPAC: InChI=1S/C11H22O2/c1-2-3-4-5-6-7-8-9-10-11(12)13/h2-10H2,1H3,(H,12,13) CH$LINK: INCHIKEY ZDPHROOEEOARMN-UHFFFAOYSA-N
AC$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: splash10-0706-9000000000-d7f6a00a2bcfd58539f5 PK$NUM_PEAK: 53 PK$PEAK: m/z int. rel.int. 15 1.05 11 26 1.22 12 27 33.2 332 28 4.37 44 29 46.33 463 30 1.02 10 31 2.05 21 39 20.36 204 40 2.59 26 41 76.89 769 42 16.45 165 43 69.96 700 44 1.48 15 45 12.93 129 53 3.53 35 54 3.25 33 55 48.08 481 56 11.69 117 57 35.42 354 58 1.28 13 59 3.29 33 60 99.99 999 61 15.71 157 67 3.12 31 68 2.33 23 69 20.75 208 70 6.77 68 71 28.85 289 72 1.4 14 73 90.02 900 74 7.38 74 81 1.73 17 82 2.29 23 83 10.33 103 84 7.63 76 85 16 160 86 1.01 10 87 13.35 134 88 1.44 14 96 1.1 11 97 6.6 66 98 3.84 38 101 5.74 57 111 1.06 11 115 6.58 66 124 2.15 22 126 2.91 29 127 1.25 13 129 15.32 153 130 1.23 12 143 12.16 122 157 2.03 20 186 6 60 //