MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007642
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007642
RECORD_TITLE: N-BUTYLACETAMID; 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$NAME: N-BUTYLACETAMID
CH$NAME: ACETYLAMIN0BUTANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C6H13NO
CH$EXACT_MASS: 115.09971
CH$SMILES: CCCCNC(C)=O
CH$IUPAC: InChI=1S/C6H13NO/c1-3-4-5-7-6(2)8/h3-5H2,1-2H3,(H,7,8)
CH$LINK: CAS
1119-49-9
CH$LINK: INCHIKEY
GYLDXXLJMRTVSS-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID2061511
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$SPLASH: splash10-00e9-9100000000-331b154c0f8098133111
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
30 99.99 999
31 3.01 30
41 1.61 16
43 7.33 73
44 35.07 351
45 3.92 39
56 3.3 33
57 2.37 24
58 6.66 67
60 17.54 175
72 54.33 543
73 74.03 740
74 3.11 31
86 30.22 302
87 3.33 33
100 28.51 285
101 1.76 18
115 34.1 341
116 6.68 67
//