MassBank Record: JP008669



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

ACCESSION: JP008669
RECORD_TITLE: BENZALDEHYDE 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$NAME: BENZALDEHYDE DIETHYL ACETAL CH$COMPOUND_CLASS: N/A CH$FORMULA: C11H16O2 CH$EXACT_MASS: 180.11503 CH$SMILES: CCOC(OCC)c(c1)cccc1 CH$IUPAC: InChI=1S/C11H16O2/c1-3-12-11(13-4-2)10-8-6-5-7-9-10/h5-9,11H,3-4H2,1-2H3 CH$LINK: INCHIKEY MAQMEXSLUSZDQM-UHFFFAOYSA-N
AC$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: splash10-0550-6900000000-dfa47991c27d1a7e71c0 PK$NUM_PEAK: 26 PK$PEAK: m/z int. rel.int. 27 8.33 83 29 14.25 143 39 1.83 18 43 1.77 18 47 8.56 86 50 3.29 33 51 10.68 107 52 2.68 27 63 1.35 14 75 5.93 59 76 1.1 11 77 30.84 308 78 5.6 56 79 44.65 447 80 2.95 30 89 1.82 18 90 1.52 15 91 2.06 21 103 4.84 48 105 17.9 179 106 2.98 30 107 63 630 108 4.81 48 123 1.36 14 135 99.99 999 136 10.29 103 //