MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008497
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008497
RECORD_TITLE: METHYL PHENYLACETATE; 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$NAME: METHYL PHENYLACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H10O2
CH$EXACT_MASS: 150.06808
CH$SMILES: COC(=O)Cc(c1)cccc1
CH$IUPAC: InChI=1S/C9H10O2/c1-11-9(10)7-8-5-3-2-4-6-8/h2-6H,7H2,1H3
CH$LINK: INCHIKEY
CRZQGDNQQAALAY-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID1044352
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$SPLASH: splash10-0006-9100000000-1edd67a79f223f827641
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
15 4.17 42
29 1.79 18
38 1.3 13
39 8.06 81
41 1.29 13
50 2.06 21
51 3.99 40
52 1.16 12
59 6.69 67
62 1.73 17
63 6.23 62
64 1.57 16
65 14.83 148
77 1.12 11
89 4.81 48
90 3.18 32
91 99.99 999
92 7.52 75
105 1.09 11
119 1.44 14
150 24 240
151 2.32 23
//