MassBank Record: MSBNK-Waters-WA001644
ACCESSION: MSBNK-Waters-WA001644
RECORD_TITLE: Ethenzamide; LC-ESI-Q; MS; POS; 15 V
DATE: 2016.01.19 (Created 2007.08.01, modified 2011.05.06)
AUTHORS: Nihon Waters K.K.
LICENSE: CC BY-NC
CH$NAME: Ethenzamide
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H11NO2
CH$EXACT_MASS: 165.07898
CH$SMILES: CCOc(c1)c(ccc1)C(N)=O
CH$IUPAC: InChI=1S/C9H11NO2/c1-2-12-8-6-4-3-5-7(8)9(10)11/h3-6H,2H2,1H3,(H2,10,11)
CH$LINK: CAS
938-73-8
CH$LINK: INCHIKEY
SBNKFTQSBPKMBZ-UHFFFAOYSA-N
CH$LINK: COMPTOX
DTXSID4020581
AC$INSTRUMENT: ZQ, Waters
AC$INSTRUMENT_TYPE: LC-ESI-Q
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$CHROMATOGRAPHY: RETENTION_TIME 13.230 min
AC$CHROMATOGRAPHY: COLUMN_NAME 2.1 mm id - 3. 5{mu}m XTerra C18MS
AC$CHROMATOGRAPHY: COLUMN_TEMPERATURE 35 C
AC$CHROMATOGRAPHY: SAMPLING_CONE 15 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-014i-0910000000-ce0295881e49741b312b
PK$NUM_PEAK: 13
PK$PEAK: m/z int. rel.int.
113 8 8
122 8 8
149 133 133
150 16 16
166 999 999
167 114 114
168 8 8
204 137 137
205 24 24
206 12 12
265 8 8
331 82 82
332 12 12
//
system version 2.2.6-SNAPSHOT