MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008427
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008427
RECORD_TITLE: P-ETHYLPHENOL; 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$NAME: P-ETHYLPHENOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H10O
CH$EXACT_MASS: 122.07316
CH$SMILES: CCc(c1)ccc(O)c1
CH$IUPAC: InChI=1S/C8H10O/c1-2-7-3-5-8(9)6-4-7/h3-6,9H,2H2,1H3
CH$LINK: INCHIKEY
HXDOZKJGKXYMEW-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4021977
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$SPLASH: splash10-0a4i-4900000000-49d46baa756331ae6778
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
27 4.65 47
29 1.05 11
38 1.39 14
39 8.88 89
40 1.05 11
41 1.4 14
50 2.43 24
51 5.49 55
52 2.6 26
53 3.73 37
55 1.69 17
62 1.27 13
63 3.49 35
65 4.72 47
66 1.29 13
77 15.69 157
78 3.96 40
79 1.99 20
91 4.38 44
94 1.34 13
103 1.47 15
107 99.99 999
108 7.62 76
121 2.84 28
122 33 330
123 2.8 28
//
system version 2.2.6-SNAPSHOT