MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007569
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007569
RECORD_TITLE: 4-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$NAME: 4-TERPINEOL
CH$NAME: 4-METHYL-1-(1-METHYLETHYL)-3-CYCLOHEXEN-1-OL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H18O
CH$EXACT_MASS: 154.13577
CH$SMILES: CC(C1)=CCC(O)(C1)C(C)C
CH$IUPAC: InChI=1S/C10H18O/c1-8(2)10(11)6-4-9(3)5-7-10/h4,8,11H,5-7H2,1-3H3
CH$LINK: CAS
562-74-3
CH$LINK: INCHIKEY
WRYLYDPHFGVWKC-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4044824
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$SPLASH: splash10-022l-9500000000-3f2e9ea1f5b3757fe0ee
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
59 14.1 141
69 38.56 386
71 99.99 999
81 18.81 188
86 48.75 488
92 14.23 142
93 59.6 596
110 7.86 79
111 61.07 611
121 13.51 135
125 5.18 52
136 17.82 178
139 31.75 318
154 32.72 327
155 2.72 27
//