MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007636
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007636
RECORD_TITLE: N-HEXYLACETAMIDE; 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$NAME: N-HEXYLACETAMIDE
CH$NAME: ACETYLAMINOHEXANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H17NO
CH$EXACT_MASS: 143.13101
CH$SMILES: CCCCCCNC(C)=O
CH$IUPAC: InChI=1S/C8H17NO/c1-3-4-5-6-7-9-8(2)10/h3-7H2,1-2H3,(H,9,10)
CH$LINK: CAS
7501-79-3
CH$LINK: INCHIKEY
SYIOXNGUUYGIIF-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID00225993
AC$INSTRUMENT: HITACHI RMU-6M
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 15 eV
MS$FOCUSED_ION: ION_TYPE [M]+*
PK$SPLASH: splash10-00e9-9200000000-e73908b7dc826f8a5220
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
30 94.96 950
31 2.26 23
42 2.14 21
43 23.34 233
44 33.24 332
45 7.27 73
55 1.57 16
56 5.3 53
58 9.63 96
59 1.39 14
60 48.13 481
61 1.19 12
71 1.69 17
72 86.91 869
73 99.99 999
74 4.34 43
86 43.82 438
87 16.4 164
100 34.92 349
101 12.14 121
114 31.45 315
115 2.68 27
128 15.61 156
129 1.23 12
143 32.9 329
144 8.39 84
//
system version 2.2.8-SNAPSHOT