MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007571
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007571
RECORD_TITLE: ALPHA-TERPINEOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TAKEUCHI T, DEP. CHEMISTRY, FAC. SCIENCE, NARA WOMEN'S UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: ALPHA-TERPINEOL
CH$NAME: (S)-ALPHA,ALPHA,4-TRIMETHYL-3-CYCLOHEXENE-1-METHANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H18O
CH$EXACT_MASS: 154.13577
CH$SMILES: CC(C1)=C([H])CC([H])(C1)C(C)(C)O
CH$IUPAC: InChI=1S/C10H18O/c1-8-4-6-9(7-5-8)10(2,3)11/h4,9,11H,5-7H2,1-3H3/t9-/m1/s1
CH$LINK: CAS
10482-56-1
CH$LINK: INCHIKEY
WUOACPNHFRMFPN-SECBINFHSA-N
CH$LINK: COMPTOX
DTXSID5052672
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$SPLASH: splash10-0a4l-9200000000-1596683e8acf54e23888
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
41 7.57 76
43 32.47 325
59 99.99 999
60 16.52 165
67 7.53 75
68 12.4 124
81 32.14 321
85 6.39 64
92 13.43 134
93 44.3 443
121 38.27 383
136 37.51 375
139 5.9 59
//