MassBank Record: JP008668



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

ACCESSION: JP008668
RECORD_TITLE: ACETALDEHYDE BENZYL HEXYL 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$NAME: ACETALDEHYDE BENZYL HEXYL ACETAL CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H24O2 CH$EXACT_MASS: 236.17763 CH$SMILES: CCCCCCOC(C)OCc(c1)cccc1 CH$IUPAC: InChI=1S/C15H24O2/c1-3-4-5-9-12-16-14(2)17-13-15-10-7-6-8-11-15/h6-8,10-11,14H,3-5,9,12-13H2,1-2H3 CH$LINK: INCHIKEY NDKDGYQWVJSTOP-UHFFFAOYSA-N
AC$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: splash10-0006-9100000000-ca401fd08b77f936762c PK$NUM_PEAK: 44 PK$PEAK: m/z int. rel.int. 15 1.06 11 26 1.24 12 27 11.77 118 29 10.76 108 31 3.92 39 38 1 10 39 7.43 74 41 20.37 204 42 6.86 69 43 59.87 599 44 3.84 38 45 5.11 51 50 2.24 22 51 5.59 56 52 1.51 15 53 1.89 19 55 10.93 109 56 13.83 138 57 5.98 60 63 1.8 18 65 6.55 66 69 4.56 46 77 11.63 116 78 2.05 21 79 12.92 129 80 1.04 10 82 2.58 26 83 1.53 15 84 2.34 23 85 18.42 184 89 2.05 21 90 2.46 25 91 99.99 999 92 17.67 177 93 1 10 105 4.03 40 106 2.4 24 107 6.4 64 108 10.23 102 113 2.99 30 129 1.68 17 133 2.22 22 134 18.13 181 135 5.14 51 //