MassBank Record: JP000121



 3,7-DIMETHYL-2,6-OCTADIEN-1-OL(CIS); EI-B; MS 
Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk) \n

ACCESSION: JP000121
RECORD_TITLE: 3,7-DIMETHYL-2,6-OCTADIEN-1-OL(CIS); 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$NAME: 3,7-DIMETHYL-2,6-OCTADIEN-1-OL(CIS) CH$NAME: NEROL CH$COMPOUND_CLASS: N/A CH$FORMULA: C10H18O CH$EXACT_MASS: 154.13577 CH$SMILES: OCC=C(C)CCC=C(C)C CH$IUPAC: InChI=1S/C10H18O/c1-9(2)5-4-6-10(3)7-8-11/h5,7,11H,4,6,8H2,1-3H3/b10-7-
AC$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-9000000000-8132ea67e057a3dd9c80 PK$NUM_PEAK: 56 PK$PEAK: m/z int. rel.int. 27 14.6 146 28 2 20 29 13.8 138 31 3.3 33 39 21.6 216 40 4.3 43 41 96.4 964 42 5.4 54 43 6.9 69 44 0.7 7 50 0.8 8 51 3.3 33 52 1.4 14 53 12.5 125 54 1.6 16 55 10.7 107 56 3.3 33 57 3 30 59 2 20 63 0.7 7 65 2.8 28 66 1.1 11 67 13.8 138 68 20.4 204 69 99.99 999 70 7.5 75 71 7.5 75 72 2.4 24 77 4.3 43 78 0.7 7 79 5.4 54 80 9.2 92 81 6.2 62 82 7.3 73 83 13.9 139 84 2.1 21 91 4.1 41 92 3.9 39 93 21 210 94 3.4 34 95 2.6 26 96 1.8 18 97 4.3 43 98 1.7 17 105 1.6 16 107 2.7 27 109 1.5 15 110 1.1 11 111 4.6 46 112 0.9 9 121 8 80 122 0.7 7 123 5 50 136 4.1 41 139 2.3 23 154 3.6 36 //