MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009075
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009075
RECORD_TITLE: 1,2-DI(2-PROPENYLOXY)BENZENE; 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$NAME: 1,2-DI(2-PROPENYLOXY)BENZENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H14O2
CH$EXACT_MASS: 190.09938
CH$SMILES: C=CCOc(c1)c(OCC=C)ccc1
CH$IUPAC: InChI=1S/C12H14O2/c1-3-9-13-11-7-5-6-8-12(11)14-10-4-2/h3-8H,1-2,9-10H2
CH$LINK: INCHIKEY
GZWLFCGQNCRLIN-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID0063361
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$SPLASH: splash10-0006-9300000000-1da18c231c4efe7ff294
PK$NUM_PEAK: 31
PK$PEAK: m/z int. rel.int.
26 1.25 13
27 3.11 31
38 1.57 16
39 19.52 195
40 1.05 11
41 99.99 999
42 3.11 31
50 1.63 16
51 4.77 48
52 11.51 115
53 2.44 24
55 2.27 23
63 2.23 22
64 1.51 15
65 2.68 27
77 3.85 39
79 1.54 15
80 4.65 47
81 7.36 74
91 2.29 23
93 3.63 36
103 1.78 18
109 9.8 98
110 1.15 12
119 9.76 98
121 9.63 96
122 1.08 11
149 12.52 125
150 1.07 11
190 18.41 184
191 1.93 19
//
system version 2.2.8-SNAPSHOT