MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP011495
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP011495
RECORD_TITLE: CYCLOHEXENE OXIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: FUJISE Y, HAMAMATSU UNIV. SCHOOL OF MEDICINE
LICENSE: CC BY-NC-SA
CH$NAME: CYCLOHEXENE OXIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H10O
CH$EXACT_MASS: 98.07316
CH$SMILES: [H]C(C2)(O1)C([H])(CCC2)1
CH$IUPAC: InChI=1S/C6H10O/c1-2-4-6-5(3-1)7-6/h5-6H,1-4H2/t5-,6+
CH$LINK: INCHIKEY
ZWAJLVLEBYIOTI-OLQVQODUSA-N
AC$INSTRUMENT: JEOL JMS-DX-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: splash10-05tf-9000000000-8c60284c636a3896c8bc
PK$NUM_PEAK: 55
PK$PEAK: m/z int. rel.int.
33 1.89 19
34 1.41 14
37 1.73 17
38 4.36 44
39 51.78 518
40 10.99 110
41 99.99 999
42 38.54 385
43 50.71 507
44 30.65 307
45 18.22 182
47 3.3 33
50 2.87 29
51 5.18 52
52 2.32 23
53 14.43 144
54 14.24 142
55 44.08 441
56 13.16 132
57 68.38 684
58 5.98 60
59 1.99 20
60 6.38 64
61 1.02 10
63 1.34 13
65 5.09 51
66 3.1 31
67 42.56 426
68 15.28 153
69 47.82 478
70 83.52 835
71 22.17 222
72 2.24 22
73 10.47 105
74 2.11 21
75 2.45 25
77 7.66 77
78 1.64 16
79 40.13 401
80 14.64 146
81 56.49 565
82 9.15 92
83 30.72 307
84 6.62 66
85 7.81 78
86 3.26 33
87 6 60
88 4.76 48
89 1.06 11
91 1.02 10
95 7.78 78
96 5.3 53
97 32.34 323
98 58.63 586
99 15.32 153
//