MassBank Record: JP009111



 ACETALDEHYDE BENZYL CIS-3-HEXENYL ACETAL; EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP009111
RECORD_TITLE: ACETALDEHYDE BENZYL CIS-3-HEXENYL 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$NAME: ACETALDEHYDE BENZYL CIS-3-HEXENYL ACETAL CH$COMPOUND_CLASS: N/A CH$FORMULA: C15H22O2 CH$EXACT_MASS: 234.16198 CH$SMILES: CCC=CCCOC(C)OCc(c1)cccc1 CH$IUPAC: InChI=1S/C15H22O2/c1-3-4-5-9-12-16-14(2)17-13-15-10-7-6-8-11-15/h4-8,10-11,14H,3,9,12-13H2,1-2H3/b5-4- CH$LINK: INCHIKEY LDEPYAQXQFOODV-PLNGDYQASA-N
AC$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: splash10-0006-9000000000-393f9dc18b67137a37b1 PK$NUM_PEAK: 26 PK$PEAK: m/z int. rel.int. 27 3.05 31 29 2.36 24 39 5.29 53 41 11.39 114 43 3.56 36 51 1.57 16 53 1.31 13 55 11.55 116 56 1.23 12 65 6.34 63 67 3.87 39 68 1.05 11 69 1.62 16 77 2.66 27 79 1.4 14 82 6.25 63 83 7.91 79 89 1.18 12 90 1.3 13 91 99.99 999 92 9.8 98 105 1.05 11 113 1.54 15 127 2.59 26 135 13.91 139 136 1.23 12 //