MassBank Record: JP000122



 3,7-DIMETHYL-2,6-OCTADIENAL(TRANS); EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000122
RECORD_TITLE: 3,7-DIMETHYL-2,6-OCTADIENAL(TRANS); EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: 3,7-DIMETHYL-2,6-OCTADIENAL(TRANS) CH$NAME: GERANIAL CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H16O CH$EXACT_MASS: 152.12012 CH$SMILES: O=CC=C(C)CCC=C(C)C CH$IUPAC: InChI=1S/C10H16O/c1-9(2)5-4-6-10(3)7-8-11/h5,7-8H,4,6H2,1-3H3/b10-7+
AC$INSTRUMENT: HITACHI RMU-6M 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: splash10-014l-9000000000-ccb0a3f327b5d2362bb9 PK$NUM_PEAK: 34 PK$PEAK: m/z int. rel.int. 27 14 140 28 13.3 133 29 9.4 94 39 21.9 219 40 3 30 41 87.3 873 42 3.3 33 43 3.9 39 51 2.7 27 52 1 10 53 9 90 54 1.9 19 55 5.3 53 56 2.6 26 59 3.4 34 65 1.8 18 67 6.6 66 68 2.2 22 69 99.99 999 70 5 50 77 2.1 21 79 2.3 23 83 6.9 69 84 24.6 246 91 2.1 21 93 1.2 12 94 12.5 125 95 3.8 38 109 6.2 62 110 1.2 12 119 1.6 16 123 4.2 42 137 3.8 38 152 6.4 64 //