MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002141
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002141
RECORD_TITLE: PHENOXY METHYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: PHENOXY METHYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H10O3
CH$EXACT_MASS: 166.06299
CH$SMILES: CC(=O)OCOc(c1)cccc1
CH$IUPAC: InChI=1S/C9H10O3/c1-8(10)11-7-12-9-5-3-2-4-6-9/h2-6H,7H2,1H3
CH$LINK: INCHIKEY
HTZSHXWXQWAYEO-UHFFFAOYSA-N
AC$INSTRUMENT: HITACHI RMU-7M
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: splash10-0ar0-9800000000-56af52db42155eee1096
PK$NUM_PEAK: 28
PK$PEAK: m/z int. rel.int.
15 3.16 32
27 1.14 11
28 4.3 43
29 1.77 18
31 1.2 12
32 1.2 12
38 1.39 14
39 6.33 63
42 1.64 16
44 3.16 32
45 8.79 88
50 3.86 39
51 14.8 148
59 2.53 25
63 1.9 19
64 1.08 11
65 6.7 67
66 1.2 12
77 73.69 737
78 6.14 61
79 23.59 236
80 1.58 16
91 1.2 12
94 3.86 39
107 99.99 999
108 8.29 83
166 59.65 597
167 5.95 60
//
system version 2.2.8-SNAPSHOT