MassBank Record: MSBNK-Fac_Eng_Univ_Tokyo-JP007976
ACCESSION: MSBNK-Fac_Eng_Univ_Tokyo-JP007976
RECORD_TITLE: PHENSUXIMIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: HAMAMATSU UNIV. SCHOOL OF MEDICINE
LICENSE: CC BY-NC-SA
CH$NAME: PHENSUXIMIDE
CH$NAME: 1-METHYL-3-PHENYL-2,5-PYRROLIDINEDIONE
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: JEOL JMS-D-300
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-ebb2c45214a57c99d4f6
PK$NUM_PEAK: 22
PK$PEAK: m/z int. rel.int.
51 11.98 120
52 4.04 40
55 1.79 18
56 1.33 13
57 1.78 18
63 2.49 25
65 1.1 11
69 1.02 10
71 1.27 13
76 1.77 18
77 9.52 95
78 11.56 116
79 1.16 12
89 1.21 12
91 1.11 11
102 4.76 48
103 11.39 114
104 99.99 999
105 9.54 95
187 1.32 13
189 27.18 272
190 3.45 35
//