MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007211
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007211
RECORD_TITLE: HEXYL METHYL ETHER; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: HEXYL METHYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H16O
CH$EXACT_MASS: 116.12012
CH$SMILES: CCCCCCOC
CH$IUPAC: InChI=1S/C7H16O/c1-3-4-5-6-7-8-2/h3-7H2,1-2H3
CH$LINK: INCHIKEY
ICBJCVRQDSQPGI-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID3063594
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$SPLASH: splash10-052b-9000000000-1e0f4edc8b6e4132c4e1
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
15 5.05 51
27 11.62 116
28 1.48 15
29 10.98 110
31 1.38 14
33 4.86 49
39 7.16 72
41 15.58 156
42 11.96 120
43 11.71 117
45 99.99 999
46 1.95 20
47 1.02 10
55 12.13 121
56 41.65 417
57 1.94 19
69 8.9 89
70 1.27 13
84 12.94 129
85 1.04 10
//