MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP003824
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP003824
RECORD_TITLE: PHENSUXIMIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: SASAKI S, TOYOHASHI UNIV. OF TECH.
LICENSE: CC BY-NC-SA
CH$NAME: PHENSUXIMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H11NO2
CH$EXACT_MASS: 189.07898
CH$SMILES: O=C(C1)N(C)C(=O)C1c(c2)cccc2
CH$IUPAC: InChI=1S/C11H11NO2/c1-12-10(13)7-9(11(12)14)8-5-3-2-4-6-8/h2-6,9H,7H2,1H3
CH$LINK: INCHIKEY
WLWFNJKHKGIJNW-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4023460
AC$INSTRUMENT: Unknown
AC$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$SPLASH: splash10-0udi-3900000000-3ea0132a234fd8153646
PK$NUM_PEAK: 31
PK$PEAK: m/z int. rel.int.
26 1.9 19
27 4.9 49
28 4.9 49
29 0.19 2
39 5.9 59
42 1.4 14
50 5.9 59
51 1.39 14
52 4.9 49
56 2.4 24
57 0.9 9
58 0.14 1
62 2.4 24
63 4.4 44
64 1.4 14
65 0.01 0
74 2.9 29
75 2.4 24
76 3.4 34
77 1.34 13
78 13.4 134
79 1.4 14
89 2.4 24
90 0.14 1
91 1.4 14
102 4.4 44
103 17.4 174
104 99.99 999
105 12.4 124
189 25.9 259
190 2.9 29
//