MassBank Record: MSBNK-Waters-WA001640
ACCESSION: MSBNK-Waters-WA001640
RECORD_TITLE: Ethenzamide; LC-ESI-Q; MS; POS; 75 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 75 V
MS$DATA_PROCESSING: FIND_PEAK ignore rel.int. < 5
PK$SPLASH: splash10-00di-0900000000-ac36620796686b682e09
PK$NUM_PEAK: 16
PK$PEAK: m/z int. rel.int.
102 35 35
103 110 110
105 129 129
106 31 31
111 59 59
113 20 20
115 12 12
118 20 20
121 999 999
122 82 82
123 8 8
130 12 12
131 74 74
132 8 8
134 12 12
204 24 24
//
system version 2.2.6-SNAPSHOT