MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006565
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006565
RECORD_TITLE: TRANS-DECAHYDRO-BETA-NAPHTHOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, CHEMICAL RESEARCH INSTITUTE OF NON-AQUEOUSSOLUTIONS TOHOKU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: TRANS-DECAHYDRO-BETA-NAPHTHOL
CH$NAME: TRANS-3-HYDROXYBICYCLO(4.4.0)DECANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H18O
CH$EXACT_MASS: 154.13577
CH$SMILES: OC(C1)CC([H])(C2)C([H])(CCC2)C1
CH$IUPAC: InChI=1S/C10H18O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h8-11H,1-7H2/t8-,9-,10?/m0/s1
CH$LINK: INCHIKEY
UPMAOXLCTXPPAG-XMCUXHSSSA-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$SPLASH: splash10-000f-9200000000-7a76c308c5a215af8a24
PK$NUM_PEAK: 56
PK$PEAK: m/z int. rel.int.
15 1.61 16
26 1.21 12
27 25.21 252
28 2.57 26
29 27 270
30 1.08 11
31 6.04 60
39 30.25 303
40 4.27 43
41 62.92 629
42 7.76 78
43 16.03 160
44 10.58 106
45 2.03 20
50 1 10
51 4.01 40
52 2.46 25
53 17.32 173
54 21.44 214
55 63.06 631
56 5.66 57
57 16.59 166
58 2.42 24
65 5.58 56
66 6.05 61
67 54.75 548
68 19.03 190
69 13.31 133
70 14.18 142
71 2.31 23
77 10.34 103
78 3.94 39
79 35.61 356
80 18.99 190
81 38.55 386
82 14.9 149
83 10.89 109
84 1.93 19
91 5.42 54
92 1.17 12
93 25.53 255
94 79.99 800
95 65.44 654
96 5.81 58
97 18.71 187
98 1.83 18
107 29.96 300
108 21.11 211
109 2.65 27
110 8.34 83
111 1.6 16
121 34.13 341
122 3.03 30
135 2.48 25
136 99.99 999
137 10.24 102
//