MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007112
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007112
RECORD_TITLE: TERT-BUTYL ALCOHOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SODA AROMATIC CO., LTD.
LICENSE: CC BY-NC-SA
CH$NAME: TERT-BUTYL ALCOHOL
CH$NAME: 2-METHYL-2-PROPANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C4H10O
CH$EXACT_MASS: 74.07316
CH$SMILES: CC(C)(C)O
CH$IUPAC: InChI=1S/C4H10O/c1-4(2,3)5/h5H,1-3H3
CH$LINK: CAS
75-65-0
CH$LINK: INCHIKEY
DKGAVHZHDRPRBM-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID8020204
AC$INSTRUMENT: HITACHI M-80B
AC$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$SPLASH: splash10-0a4i-9000000000-de7e1d9fd31a3d61613f
PK$NUM_PEAK: 15
PK$PEAK: m/z int. rel.int.
15 2.97 30
27 3.81 38
28 1.23 12
29 5.6 56
31 17.71 177
39 5.2 52
41 14.05 141
42 2.66 27
43 11.3 113
44 1.31 13
55 1.63 16
56 1.4 14
57 8.52 85
59 99.99 999
60 3.77 38
//