MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP009522
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP009522
RECORD_TITLE: N-METHYLACETAMIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: NARA WOMEN'S UNIVERSITY
LICENSE: CC BY-NC-SA
CH$NAME: N-METHYLACETAMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C3H7NO
CH$EXACT_MASS: 73.05276
CH$SMILES: CNC(C)=O
CH$IUPAC: InChI=1S/C3H7NO/c1-3(5)4-2/h1-2H3,(H,4,5)
CH$LINK: CAS
79-16-3
CH$LINK: INCHIKEY
OHLUUHNLEMFGTQ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID0047167
AC$INSTRUMENT: HITACHI M-80
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: splash10-002f-9000000000-99a9c9899c3192926982
PK$NUM_PEAK: 26
PK$PEAK: m/z int. rel.int.
12 1.75 18
13 9.76 98
15 28.92 289
16 1.3 13
25 2.85 29
26 7.05 71
27 47.84 478
28 10.75 108
30 38.27 383
31 8.43 84
32 2.29 23
38 1.32 13
39 2.16 22
40 3.15 32
41 5.98 60
42 16.48 165
43 99.99 999
44 5.05 51
45 4.69 47
54 1.21 12
55 1.39 14
56 1.39 14
58 42.26 423
59 1 10
73 38.54 385
74 5.25 53
//
system version 2.2.8-SNAPSHOT