MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006930
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006930
RECORD_TITLE: 4-TERPINENOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAJIMA S, GUNMA COLLEGE OF TECHNOLOGY
LICENSE: CC BY-NC-SA
CH$NAME: 4-TERPINENOL
CH$NAME: 4-METHYL-1-(1-METHYLETHYL)-3-CYCLOHEXEN-1-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H18O
CH$EXACT_MASS: 154.13577
CH$SMILES: CC(C1)=CCC(O)(C1)C(C)C
CH$IUPAC: InChI=1S/C10H18O/c1-8(2)10(11)6-4-9(3)5-7-10/h4,8,11H,5-7H2,1-3H3
CH$LINK: INCHIKEY
WRYLYDPHFGVWKC-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4044824
AC$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: splash10-006x-9100000000-575f0430fad8f36207fc
PK$NUM_PEAK: 59
PK$PEAK: m/z int. rel.int.
15 1.22 12
27 17.75 178
28 1.54 15
29 6.65 67
31 2.04 20
39 16.37 164
40 4.17 42
41 32.84 328
42 4.1 41
43 44.78 448
44 1.5 15
45 1.7 17
51 3.73 37
52 1.69 17
53 13.69 137
54 1.82 18
55 22.37 224
56 1.28 13
57 3.27 33
58 1.44 14
59 1.29 13
65 4.43 44
66 1.82 18
67 16.03 160
68 15.24 152
69 21.1 211
70 4.56 46
71 99.99 999
72 5.1 51
77 10.36 104
78 1.7 17
79 4.82 48
81 11.77 118
82 3.96 40
83 10.15 102
84 1.33 13
85 1.45 15
86 26.78 268
87 1.68 17
91 8.66 87
92 7.19 72
93 43.32 433
94 4.83 48
95 7.87 79
96 1.04 10
97 1.21 12
98 1.3 13
107 1.02 10
109 1.3 13
110 6.34 63
111 52.64 526
112 4.1 41
121 1.57 16
125 1.93 19
136 7.39 74
137 1.21 12
139 1.95 20
154 17.62 176
155 1.7 17
//