MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP004116
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP004116
RECORD_TITLE: N-METHYLBENZAMIDE; 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$NAME: N-METHYLBENZAMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H9NO
CH$EXACT_MASS: 135.06841
CH$SMILES: CNC(=O)c(c1)cccc1
CH$IUPAC: InChI=1S/C8H9NO/c1-9-8(10)7-5-3-2-4-6-7/h2-6H,1H3,(H,9,10)
CH$LINK: INCHIKEY
NCCHARWOCKOHIH-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID5025570
AC$INSTRUMENT: HITACHI M-68
AC$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$SPLASH: splash10-0a70-9800000000-e05b7564e0c71ca0b143
PK$NUM_PEAK: 28
PK$PEAK: m/z int. rel.int.
14 6 60
15 4.6 46
29 3.2 32
30 2.3 23
31 2.1 21
35 3.5 35
36 19.7 197
37 0.19 2
38 7.2 72
39 3.9 39
43 6.1 61
44 1.17 12
50 11.1 111
51 27.6 276
52 2.6 26
58 0.6 6
73 2.5 25
74 5.6 56
75 4.9 49
76 0.49 5
77 68.3 683
78 6 60
105 99.99 999
106 0.93 9
133 1.8 18
134 30.3 303
135 49 490
136 4.5 45
//
system version 2.2.8-SNAPSHOT