MassBank Record: JP009291



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

ACCESSION: JP009291
RECORD_TITLE: ACETALDEHYDE BUTYL ISOPROPYL 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$NAME: ACETALDEHYDE BUTYL ISOPROPYL ACETAL CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H20O2 CH$EXACT_MASS: 160.14633 CH$SMILES: CCCCOC(C)OC(C)C CH$IUPAC: InChI=1S/C9H20O2/c1-5-6-7-10-9(4)11-8(2)3/h8-9H,5-7H2,1-4H3 CH$LINK: INCHIKEY MDDRKDNGWLHURG-UHFFFAOYSA-N
AC$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: splash10-0002-9100000000-d0824f08143fcf25283e PK$NUM_PEAK: 25 PK$PEAK: m/z int. rel.int. 15 1.5 15 27 11.3 113 28 3.1 31 29 1.41 14 31 2.6 26 39 4.5 45 41 22.5 225 42 0.3 3 43 29.3 293 44 2.5 25 45 99.99 999 46 0.22 2 55 3 30 56 2.7 27 57 53.3 533 58 0.28 3 61 2.9 29 69 2.2 22 73 1.1 11 87 5.33 53 88 2.9 29 101 18.3 183 102 1.4 14 103 0.75 8 145 11.5 115 //