MassBank Record: JP008654



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

ACCESSION: JP008654
RECORD_TITLE: ACETALDEHYDE DI-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$NAME: ACETALDEHYDE DI-CIS-3-HEXENYL ACETAL CH$COMPOUND_CLASS: N/A CH$FORMULA: C14H26O2 CH$EXACT_MASS: 226.19328 CH$SMILES: CCC=CCCOC(C)OCCC=CCC CH$IUPAC: InChI=1S/C14H26O2/c1-4-6-8-10-12-15-14(3)16-13-11-9-7-5-2/h6-9,14H,4-5,10-13H2,1-3H3/b8-6-,9-7- CH$LINK: INCHIKEY KCPFRJBAXWUXIG-VRHVFUOLSA-N
AC$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: splash10-053r-9100000000-38ccc0731acd50b42f5e PK$NUM_PEAK: 22 PK$PEAK: m/z int. rel.int. 27 2.78 28 29 3.79 38 39 4.77 48 40 1.38 14 41 23.13 231 42 1.84 18 43 3.7 37 45 1.98 20 53 3.16 32 54 2.72 27 55 55.2 552 56 3.08 31 58 1.87 19 67 8.12 81 68 1.33 13 69 3.41 34 81 1.24 12 82 6.37 64 83 99.99 999 84 6.66 67 127 34.27 343 128 2.92 29 //