MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP012082
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP012082
RECORD_TITLE: 7BETA-ISOPROPENYL-1,(4A)BETA-DIMETHYL-3,4,(4A),5,6,7,8,8ABETA-OCTAHYDRONAPHTHALENE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, INSTITUTE FOR CHEMICAL REACTION SCIENCE TOHOKU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 7BETA-ISOPROPENYL-1,(4A)BETA-DIMETHYL-3,4,(4A),5,6,7,8,8ABETA-OCTAHYDRONAPHTHALENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C15H24
CH$EXACT_MASS: 204.18780
CH$SMILES: CC(=C)C([H])(C1)CC([H])(C(C)=2)C(C)(CCC([H])2)C1
CH$IUPAC: InChI=1S/C15H24/c1-11(2)13-7-9-15(4)8-5-6-12(3)14(15)10-13/h6,13-14H,1,5,7-10H2,2-4H3/t13-,14-,15-/m1/s1
CH$LINK: INCHIKEY
OZQAPQSEYFAMCY-RBSFLKMASA-N
AC$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: splash10-052f-9800000000-3a5b6d89a35ea45419e1
PK$NUM_PEAK: 52
PK$PEAK: m/z int. rel.int.
36 15 150
39 26.2 262
40 18 180
41 64.4 644
42 14.4 144
43 78.8 788
44 20 200
53 24 240
55 42.1 421
58 25.5 255
59 23 230
65 23.8 238
67 39.1 391
68 30.9 309
69 20.4 204
73 38 380
77 25.3 253
79 48.1 481
80 16.3 163
81 56.2 562
82 15.9 159
88 13.9 139
91 50.2 502
92 19.7 197
93 74.5 745
94 29.6 296
95 35.8 358
97 29.2 292
105 47.2 472
106 23 230
107 78.1 781
108 51.7 517
109 86.3 863
110 21.3 213
119 27.7 277
120 21.3 213
121 38.8 388
122 73.4 734
123 24.9 249
133 32.8 328
134 19.7 197
135 20.4 204
147 27 270
148 16.7 167
149 15 150
161 99.99 999
162 29.4 294
163 17.2 172
175 22.8 228
189 30.3 303
204 47.6 476
205 15.5 155
//