MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007637
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007637
RECORD_TITLE: N-(3-METHYLBUTYL)ACETAMIDE; 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$NAME: N-(3-METHYLBUTYL)ACETAMIDE
CH$NAME: ACETYLAMINO-3-METHYLBUTANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H15NO
CH$EXACT_MASS: 129.11536
CH$SMILES: CC(C)CCNC(C)=O
CH$IUPAC: InChI=1S/C7H15NO/c1-6(2)4-5-8-7(3)9/h6H,4-5H2,1-3H3,(H,8,9)
CH$LINK: INCHIKEY
XWDCLPNMPBQWCW-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID10158662
AC$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: splash10-0230-9100000000-9c85b282418843a86ce0
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
30 99.99 999
31 3.7 37
32 1.01 10
42 2.13 21
43 4.15 42
44 4.05 41
45 5.06 51
55 3.18 32
56 1.71 17
57 2 20
58 14.1 141
60 75.9 759
61 1.8 18
70 9.12 91
71 1.13 11
72 84.24 842
73 71.32 713
74 8.15 82
86 4.82 48
100 53.12 531
101 3.17 32
114 10.1 101
129 11.37 114
130 5.76 58
//
system version 2.2.6-SNAPSHOT