MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP008611
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP008611
RECORD_TITLE: BENZYLACETOPHENONE; 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$NAME: BENZYLACETOPHENONE
CH$NAME: 3-PHENYLPROPIOPHENONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H14O
CH$EXACT_MASS: 210.10447
CH$SMILES: O=C(CCc(c2)cccc2)c(c1)cccc1
CH$IUPAC: InChI=1S/C15H14O/c16-15(14-9-5-2-6-10-14)12-11-13-7-3-1-4-8-13/h1-10H,11-12H2
CH$LINK: INCHIKEY
QGGZBXOADPVUPN-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID7061481
AC$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-7930000000-932c5f7279d2b7703686
PK$NUM_PEAK: 21
PK$PEAK: m/z int. rel.int.
18 1.71 17
27 2.4 24
39 2.95 30
50 2.93 29
51 10.54 105
52 1.47 15
63 1.61 16
65 3.42 34
76 1.57 16
77 43.43 434
78 4.69 47
79 2.53 25
89 1.03 10
91 9.02 90
103 2.96 30
104 4.27 43
105 99.99 999
106 6.79 68
209 1.71 17
210 32.89 329
211 4.9 49
//
system version 2.2.6-SNAPSHOT