MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007638
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007638
RECORD_TITLE: N-PENTYLACETAMIDE; 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$NAME: N-PENTYLACETAMIDE
CH$NAME: ACETYLAMINOPENTANE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H15NO
CH$EXACT_MASS: 129.11536
CH$SMILES: CCCCCNC(C)=O
CH$IUPAC: InChI=1S/C7H15NO/c1-3-4-5-6-8-7(2)9/h3-6H2,1-2H3,(H,8,9)
CH$LINK: CAS
2524-60-9
CH$LINK: INCHIKEY
PTBCMKWBUAWWMQ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID40278089
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$SPLASH: splash10-00e9-9200000000-e18063411777db4084ed
PK$NUM_PEAK: 24
PK$PEAK: m/z int. rel.int.
28 1.28 13
30 99.99 999
31 2.38 24
42 3.13 31
43 5.06 51
44 31.69 317
45 4.34 43
55 1.77 18
56 1.14 11
58 9.59 96
59 1.14 11
60 21.49 215
70 1.99 20
72 71.95 720
73 84.76 848
74 3.39 34
86 34.51 345
87 14.33 143
100 29.36 294
101 2.52 25
114 27.04 270
115 1.73 17
129 28.76 288
130 4.73 47
//
system version 2.2.8-SNAPSHOT