MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007574
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007574
RECORD_TITLE: TERPINYL ACETATE; 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$NAME: TERPINYL ACETATE
CH$NAME: ACETIC ACID PARA-MENTH-1-EN-8-OL ESTER
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C12H20O2
CH$EXACT_MASS: 196.14633
CH$SMILES: CC(=O)OC(C)(C)C(C1)CCC(=C)C1
CH$IUPAC: InChI=1S/C12H20O2/c1-9-5-7-11(8-6-9)12(3,4)14-10(2)13/h11H,1,5-8H2,2-4H3
CH$LINK: CAS
8007-35-0
CH$LINK: INCHIKEY
IWKXKWUCSZHJEK-UHFFFAOYSA-N
AC$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: splash10-00rf-9600000000-87aa6500b5f415c4625c
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
59 24.39 244
60 5.36 54
68 63.64 636
69 47.29 473
80 23.91 239
81 26.5 265
92 37.8 378
93 97.59 976
107 28.31 283
108 19.64 196
121 92.39 924
122 14.88 149
136 68.37 684
137 22.18 222
//