MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009815
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009815
RECORD_TITLE: 5-HYDROXY-3-METHYL-1-UNDECENE; 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$NAME: 5-HYDROXY-3-METHYL-1-UNDECENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H24O
CH$EXACT_MASS: 184.18272
CH$SMILES: CCCCCCC(O)CC(C)C=C
CH$IUPAC: InChI=1S/C12H24O/c1-4-6-7-8-9-12(13)10-11(3)5-2/h5,11-13H,2,4,6-10H2,1,3H3
CH$LINK: INCHIKEY
ONXKCUDRJQBVFX-UHFFFAOYSA-N
AC$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: splash10-0ab9-9000000000-dc82a535b0cc1fa15d18
PK$NUM_PEAK: 44
PK$PEAK: m/z int. rel.int.
27 7.2 72
28 3 30
29 11.8 118
31 0.19 2
39 6.4 64
41 21.8 218
42 7.1 71
43 3.39 34
44 3.5 35
45 1.8 18
53 4.4 44
54 0.34 3
55 99.99 999
56 7.8 78
57 8.6 86
58 1.3 13
59 4 40
67 7.4 74
68 33.2 332
69 2.17 22
70 41.5 415
71 17.1 171
72 2.8 28
79 0.18 2
81 47.2 472
82 8.2 82
83 2.8 28
85 0.43 4
86 1.4 14
95 10.8 108
96 7.4 74
97 2.74 27
98 2.5 25
99 14.2 142
109 5.2 52
110 0.72 7
113 3 30
115 3.6 36
123 1.4 14
128 0.38 4
129 1.6 16
137 1.8 18
155 5.5 55
166 1.8 18
//