MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007218
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007218
RECORD_TITLE: P-CRESYL 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$NAME: P-CRESYL METHYL ETHER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H10O
CH$EXACT_MASS: 122.07316
CH$SMILES: COc(c1)ccc(C)c1
CH$IUPAC: InChI=1S/C8H10O/c1-7-3-5-8(9-2)6-4-7/h3-6H,1-2H3
CH$LINK: INCHIKEY
CHLICZRVGGXEOD-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID9026710
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$SPLASH: splash10-00fr-9700000000-8de5209fd4895b0fcbba
PK$NUM_PEAK: 32
PK$PEAK: m/z int. rel.int.
15 8.12 81
26 1.43 14
27 8.54 85
29 1.57 16
38 2.59 26
39 14.87 149
41 1.63 16
50 8.91 89
51 17.09 171
52 10.58 106
53 8.32 83
61 1.33 13
62 2.55 26
63 7.96 80
64 1.78 18
65 8.36 84
74 1.16 12
75 1.08 11
77 42.96 430
78 13.53 135
79 29.89 299
80 1.56 16
89 2.43 24
90 1.93 19
91 22.07 221
92 7.62 76
93 1.18 12
107 29.93 299
108 2.07 21
121 42.79 428
122 99.99 999
123 8.55 86
//
system version 2.2.6-SNAPSHOT