MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP006560
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP006560
RECORD_TITLE: 5-NONANOL; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HISAHIRO HAGIWARA, CHEMICAL RESEARCH INSTITUTE OF NON-AQUEOUSSOLUTIONS TOHOKU UNIV.
LICENSE: CC BY-NC-SA
CH$NAME: 5-NONANOL
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H20O
CH$EXACT_MASS: 144.15142
CH$SMILES: CCCCC(O)CCCC
CH$IUPAC: InChI=1S/C9H20O/c1-3-5-7-9(10)8-6-4-2/h9-10H,3-8H2,1-2H3
CH$LINK: INCHIKEY
FCBBRODPXVPZAH-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID70211368
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$SPLASH: splash10-014r-9000000000-d5ba4297d392507c447d
PK$NUM_PEAK: 20
PK$PEAK: m/z int. rel.int.
27 10.34 103
29 13.69 137
31 4.57 46
39 5.17 52
41 32.04 320
42 2.28 23
43 11.2 112
44 5.91 59
45 9.05 91
53 1.05 11
55 5.96 60
56 1.8 18
57 10.46 105
58 2.46 25
69 99.99 999
70 6.08 61
86 4.5 45
87 57.75 578
88 2.66 27
126 1.6 16
//