MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004932
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004932
RECORD_TITLE: L-MENTHONE; 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$NAME: L-MENTHONE
CH$NAME: L-P-MENTHAN-3-ONE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H18O
CH$EXACT_MASS: 154.13577
CH$SMILES: CC(C1)CC(=O)C(C1)C(C)C
CH$IUPAC: InChI=1S/C10H18O/c1-7(2)9-5-4-8(3)6-10(9)11/h7-9H,4-6H2,1-3H3/t8-,9?/m0/s1
CH$LINK: INCHIKEY
NFLGAXVYCFJBMK-IENPIDJESA-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$SPLASH: splash10-03di-9700000000-2cb64410c8a8e0320328
PK$NUM_PEAK: 37
PK$PEAK: m/z int. rel.int.
42 7.79 78
43 14.53 145
53 3.61 36
54 1.44 14
55 33.07 331
56 21.88 219
57 5.11 51
58 1.44 14
67 4.24 42
68 3.6 36
69 53.95 540
70 25.91 259
71 4.21 42
77 1.44 14
79 2.32 23
81 4.19 42
82 1.5 15
83 19.82 198
84 12.14 121
85 1.89 19
93 2.77 28
94 1.83 18
95 14.12 141
96 2.04 20
97 20.74 207
98 9.95 100
109 2.13 21
110 7.61 76
111 24.96 250
112 99.99 999
113 7.84 78
121 4.59 46
125 7.05 71
139 42.9 429
140 4.5 45
154 32.59 326
155 3.76 38
//