MassBank Record: JP008638



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

ACCESSION: JP008638
RECORD_TITLE: VALERALDEHYDE DIETHYL 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$NAME: VALERALDEHYDE DIETHYL ACETAL CH$COMPOUND_CLASS: N/A CH$FORMULA: C9H20O2 CH$EXACT_MASS: 160.14633 CH$SMILES: CCCCC(OCC)OCC CH$IUPAC: InChI=1S/C9H20O2/c1-4-7-8-9(10-5-2)11-6-3/h9H,4-8H2,1-3H3 CH$LINK: INCHIKEY XCWKYQWOLSOBCC-UHFFFAOYSA-N
AC$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: splash10-0gdj-9300000000-7ff997e019a72bfc9e85 PK$NUM_PEAK: 37 PK$PEAK: m/z int. rel.int. 15 1.95 20 19 1.68 17 26 2.1 21 27 27.43 274 29 48.84 488 30 1.87 19 31 14.13 141 39 7.85 79 41 27.47 275 42 2.68 27 43 11.32 113 44 10.02 100 45 13.83 138 46 1.24 12 47 74.27 743 53 1.08 11 55 3.29 33 57 38.22 382 58 6.37 64 59 5.36 54 60 1 10 67 1.13 11 69 67.6 676 70 3.4 34 71 1.25 13 72 2.41 24 75 50.36 504 76 1.29 13 85 16.62 166 86 1.31 13 87 11.38 114 88 1.85 19 103 99.99 999 104 5.55 56 114 3.65 37 115 61.83 618 116 3.92 39 //