MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009739
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009739
RECORD_TITLE: ,2-DIMETHYLBUTANE; 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$NAME: ,2-DIMETHYLBUTANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H14
CH$EXACT_MASS: 86.10955
CH$SMILES: CCC(C)(C)C
CH$IUPAC: InChI=1S/C6H14/c1-5-6(2,3)4/h5H2,1-4H3
CH$LINK: INCHIKEY
HNRMPXKDFBEGFZ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4025111
AC$INSTRUMENT: HITACHI RMU-6M
AC$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$SPLASH: splash10-0abc-9000000000-e9b80bec17a2e6f35a9d
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
27 1.4 14
28 1.9 19
29 15.8 158
41 2.82 28
42 2 20
43 80.2 802
44 3 30
55 0.75 8
56 33 330
57 99.99 999
58 4.2 42
70 0.46 5
71 86 860
72 4.6 46
//
system version 2.2.6-SNAPSHOT