MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007156
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007156
RECORD_TITLE: CIS-L-CARVYL ACETATE; 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$NAME: CIS-L-CARVYL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H18O2
CH$EXACT_MASS: 194.13068
CH$SMILES: CC(=O)OC([H])(C(C)=1)CC([H])(C(C)=C)CC1
CH$IUPAC: InChI=1S/C12H18O2/c1-8(2)11-6-5-9(3)12(7-11)14-10(4)13/h5,11-12H,1,6-7H2,2-4H3/t11-,12-/m1/s1
CH$LINK: INCHIKEY
YTHRBOFHFYZBRJ-VXGBXAGGSA-N
AC$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: splash10-000x-9500000000-9ea671d266cfa2912429
PK$NUM_PEAK: 72
PK$PEAK: m/z int. rel.int.
15 3.56 36
27 12.49 125
29 7.73 77
38 1.01 10
39 30.01 300
40 3.78 38
41 36.04 360
42 3.26 33
43 97.82 978
44 2.55 26
45 1.13 11
50 1.81 18
51 6.09 61
52 3.89 39
53 18.76 188
54 18.14 181
55 20.79 208
56 3.62 36
58 2.95 30
61 1.76 18
63 1.72 17
65 8 80
66 3.55 36
67 12.18 122
68 6.42 64
69 7.4 74
71 1.14 11
72 1.14 11
77 18.58 186
78 4.94 49
79 26.08 261
80 11.91 119
81 10.27 103
82 38.36 384
83 9.63 96
84 99.99 999
85 5.3 53
89 1.02 10
91 45.65 457
92 30.03 300
93 36.67 367
94 7.85 79
95 6.42 64
96 4.51 45
97 3.7 37
103 2.75 28
104 1.61 16
105 23.32 233
106 12.7 127
107 18.35 184
108 21.26 213
109 65.92 659
110 6.52 65
111 1.35 14
115 2.42 24
117 5.37 54
118 1.3 13
119 83.02 830
120 7.46 75
121 1.87 19
122 1.86 19
123 4.49 45
124 2.39 24
126 3.71 37
133 4.09 41
134 50.57 506
135 6.66 67
137 5.23 52
150 4.27 43
151 10.11 101
152 57.23 572
153 5.98 60
//