MassBank Record: JP008454



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

ACCESSION: JP008454
RECORD_TITLE: HEPTANAL DIETHYL ACETAL; EI-B; MS
DATE: 2016.01.19 (2008.10.21, 2011.05.06)
AUTHORS: , SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA

CH$NAME: HEPTANAL DIETHYL ACETAL CH$COMPOUND_CLASS: N/A CH$FORMULA: C11H24O2 CH$EXACT_MASS: 188.17763 CH$SMILES: CCCCCCC(OCC)OCC CH$IUPAC: InChI=1S/C11H24O2/c1-4-7-8-9-10-11(12-5-2)13-6-3/h11H,4-10H2,1-3H3 CH$LINK: INCHIKEY UGOCNHASEZIJFQ-UHFFFAOYSA-N
AC$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: splash10-0ufv-9400000000-8fb7540495be524254b7 PK$NUM_PEAK: 36 PK$PEAK: m/z int. rel.int. 15 1 10 19 1.11 11 27 14.91 149 28 1.92 19 29 32.19 322 30 1.09 11 31 3.81 38 39 3.68 37 41 17.89 179 42 2.44 24 43 14.1 141 44 8.02 80 45 4.6 46 47 51.27 513 53 1.25 13 55 34.69 347 56 2.05 21 57 12.4 124 58 1.63 16 59 3.38 34 67 1.26 13 69 6.17 62 70 1.05 11 72 3.5 35 73 1.12 11 75 34.91 349 76 1.07 11 85 5.69 57 88 1.93 19 97 18.45 185 98 1.32 13 103 99.99 999 104 4.92 49 113 1.23 12 143 30.05 301 144 2.82 28 //