MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004787
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004787
RECORD_TITLE: 4-METHYL-4-PARA-TOLYLSPIRO(4,5)DECAN-1-ONE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: MASS SPECTROSCOPY SOC. OF JAPAN (MSSJ)
LICENSE: CC BY-NC-SA
CH$NAME: 4-METHYL-4-PARA-TOLYLSPIRO(4,5)DECAN-1-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C18H24O
CH$EXACT_MASS: 256.18272
CH$SMILES: Cc(c3)ccc(c3)C(C)(C1)C(C2)(CCCC2)C(=O)C1
CH$IUPAC: InChI=1S/C18H24O/c1-14-6-8-15(9-7-14)17(2)13-10-16(19)18(17)11-4-3-5-12-18/h6-9H,3-5,10-13H2,1-2H3
CH$LINK: INCHIKEY
QBXOFBXUZLPVDH-UHFFFAOYSA-N
AC$INSTRUMENT: JEOL JMS-D-3000
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: splash10-001i-6920000000-6360669ff611e21c076e
PK$NUM_PEAK: 43
PK$PEAK: m/z int. rel.int.
29 3.16 32
32 92.33 923
40 6.42 64
41 5.48 55
43 8.52 85
44 3.55 36
53 2.47 25
55 6.4 64
67 7.28 73
77 3.74 37
79 5.15 52
80 6.03 60
81 14.53 145
82 2.98 30
83 23.3 233
91 9.47 95
92 2.93 29
95 3.74 37
105 8.57 86
109 4.91 49
110 3.21 32
111 8.5 85
115 5.65 57
116 2.8 28
117 8.83 88
119 8.65 87
124 47.38 474
125 5.24 52
128 4.21 42
129 4.46 45
130 2.75 28
131 10.51 105
132 99.99 999
133 18.47 185
137 2.51 25
143 4.24 42
145 20.16 202
146 4.61 46
160 7.58 76
173 3.43 34
241 3.58 36
256 53.11 531
257 10.73 107
//