MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP010114
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP010114
RECORD_TITLE: 5-METHYL-2-PHENYL-2-PROPYLE-4-HEXENE-1-OL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: KURARAY CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: 5-METHYL-2-PHENYL-2-PROPYLE-4-HEXENE-1-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C16H24O
CH$EXACT_MASS: 232.18272
CH$SMILES: CCCC(CO)(CC=C(C)C)c(c1)cccc1
CH$IUPAC: InChI=1S/C16H24O/c1-4-11-16(13-17,12-10-14(2)3)15-8-6-5-7-9-15/h5-10,17H,4,11-13H2,1-3H3
CH$LINK: INCHIKEY
BEDUQJQVSNUTQR-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-D-300
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: splash10-03di-5900000000-671eb219034146b564e9
PK$NUM_PEAK: 42
PK$PEAK: m/z int. rel.int.
27 4.2 42
29 4.2 42
31 2.1 21
39 0.21 2
41 14.6 146
43 14.6 146
53 2.1 21
55 0.42 4
57 4.2 42
65 2.1 21
67 2.1 21
69 1.25 13
70 7.3 73
71 31.3 313
72 3.1 31
77 0.63 6
78 2.1 21
79 5.2 52
85 3.1 31
91 5.1 51
92 4.2 42
93 2.1 21
103 6.3 63
105 0.83 8
107 15.6 156
115 5.2 52
116 2.1 21
117 0.63 6
118 3.1 31
119 4.2 42
121 13.5 135
128 0.31 3
129 5.2 52
130 2.1 21
131 4.2 42
133 0.42 4
143 2.1 21
145 22.9 229
146 4.2 42
162 1.77 18
163 99.99 999
164 12.5 125
//