MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007398
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007398
RECORD_TITLE: ALPHA-TERPINENE; 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$NAME: ALPHA-TERPINENE
CH$NAME: 1-METHYL-4-(1-METHYLETHYL)-1,3-CYCLOHEXADIENE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H16
CH$EXACT_MASS: 136.12520
CH$SMILES: CC(C)C(C1)=C([H])C([H])=C(C)C1
CH$IUPAC: InChI=1S/C10H16/c1-8(2)10-6-4-9(3)5-7-10/h4,6,8H,5,7H2,1-3H3
CH$LINK: CAS
99-86-5
CH$LINK: INCHIKEY
YHQGMYUVUMAZJR-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID9041237
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$SPLASH: splash10-00du-6900000000-41fde84dbd73528ad68f
PK$NUM_PEAK: 23
PK$PEAK: m/z int. rel.int.
29 2.27 23
41 2.13 21
43 11.04 110
55 2.72 27
67 1.49 15
77 10.83 108
78 1.38 14
79 14.78 148
80 5.06 51
81 1.87 19
91 16.23 162
92 9.56 96
93 78.32 783
94 8.4 84
105 10.99 110
106 2.96 30
107 11.71 117
108 5.72 57
119 2.29 23
121 99.99 999
122 10.25 103
136 75.02 750
137 8.96 90
//