MassBank Record: JP009283



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

ACCESSION: JP009283
RECORD_TITLE: BENZALDEHYDE BENZYL ETHYL 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$NAME: BENZALDEHYDE BENZYL ETHYL ACETAL CH$COMPOUND_CLASS: N/A CH$FORMULA: C16H18O2 CH$EXACT_MASS: 242.13068 CH$SMILES: CCOC(OCc(c2)cccc2)c(c1)cccc1 CH$IUPAC: InChI=1S/C16H18O2/c1-2-17-16(15-11-7-4-8-12-15)18-13-14-9-5-3-6-10-14/h3-12,16H,2,13H2,1H3 CH$LINK: INCHIKEY PNNHDYOYZSRBLH-UHFFFAOYSA-N
AC$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: splash10-000f-9500000000-82830e1aedb8e6aa464f PK$NUM_PEAK: 29 PK$PEAK: m/z int. rel.int. 27 2.7 27 29 6.5 65 39 4.2 42 41 0.15 2 50 2.1 21 51 12.3 123 52 2.9 29 63 0.26 3 64 1.3 13 65 12.8 128 77 26.5 265 78 0.4 4 79 27.8 278 80 1.7 17 89 2.7 27 90 0.23 2 91 99.99 999 92 15.1 151 105 11.7 117 106 0.17 2 107 34.9 349 108 2 20 135 63.7 637 136 1.8 18 137 1.5 15 151 4 40 167 1.5 15 196 0.22 2 197 6.2 62 //