MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP002602
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP002602
RECORD_TITLE: ISONORBORNYL ACETATE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: YAMAMOTO M, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: ISONORBORNYL ACETATE
CH$NAME: EXO-BICYCLO(2.2.1)HEPT-2-YL ACETATE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H14O2
CH$EXACT_MASS: 154.09938
CH$SMILES: CC(=O)OC(C1)C(C2)CC(C2)1
CH$IUPAC: InChI=1S/C9H14O2/c1-6(10)11-9-5-7-2-3-8(9)4-7/h7-9H,2-5H2,1H3/t7-,8+,9+/m1/s1
CH$LINK: INCHIKEY
YXNICIBZSREEPY-VGMNWLOBSA-N
AC$INSTRUMENT: HITACHI M-80
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 20 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-00kf-9100000000-5509aa9faffa844254cf
PK$NUM_PEAK: 34
PK$PEAK: m/z int. rel.int.
41 1.14 11
43 74.55 746
44 1.87 19
55 2.91 29
57 1.25 13
58 9.06 91
59 9.64 96
66 94.5 945
67 35.34 353
68 7.46 75
69 1.03 10
70 1.97 20
71 17.62 176
79 21.99 220
80 1.88 19
81 2.83 28
82 1.23 12
83 8.07 81
84 4.62 46
87 2.13 21
92 1.09 11
93 8.51 85
94 99.99 999
95 24.01 240
96 7.65 77
97 5.07 51
108 3.11 31
110 8.53 85
111 42.41 424
112 13.2 132
113 1.59 16
126 7.76 78
139 2.06 21
154 2.94 29
//