MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004750
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004750
RECORD_TITLE: METHYL 4-METHYLENECYCLOHEXANECARBOXYLATE; 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$NAME: METHYL 4-METHYLENECYCLOHEXANECARBOXYLATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H14O2
CH$EXACT_MASS: 154.09938
CH$SMILES: COC(=O)C(C1)CCC(=C)C1
CH$IUPAC: InChI=1S/C9H14O2/c1-7-3-5-8(6-4-7)9(10)11-2/h8H,1,3-6H2,2H3
CH$LINK: INCHIKEY
SYRKANZKKKAWNJ-UHFFFAOYSA-N
AC$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: splash10-000g-9100000000-594f493605fd4b954e02
PK$NUM_PEAK: 39
PK$PEAK: m/z int. rel.int.
40 3.28 33
42 13.83 138
43 1.71 17
45 1.36 14
51 2.6 26
52 1.67 17
53 8.71 87
54 3.62 36
55 29.96 300
56 1.37 14
59 4.67 47
63 1.01 10
65 3.7 37
66 2.91 29
67 15.99 160
68 19.61 196
69 2.12 21
77 8.07 81
78 2.01 20
79 33.36 334
80 5.43 54
81 2.44 24
87 58.63 586
88 2.71 27
91 5.15 52
92 1.15 12
93 9.47 95
94 99.99 999
95 57.62 576
96 4.19 42
107 1.09 11
111 1.39 14
122 27.77 278
123 14.14 141
124 1.26 13
125 1.23 12
139 2.12 21
154 10.21 102
155 1.13 11
//
system version 2.2.8-SNAPSHOT