MassBank Record: MSBNK-AGILENT-AG000050
ACCESSION: MSBNK-AGILENT-AG000050
RECORD_TITLE: Aminocarb; ESI-QTOF; MS2; CE: 40; [M+H]+
DATE: 2023.02.17
AUTHORS: Rennie E, McEachran A, Agilent Technologies
LICENSE: CC BY
CH$NAME: Aminocarb
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C11H16N2O2
CH$EXACT_MASS: 208.12118
CH$SMILES: CC1=CC(=CC=C1N(C)C)OC(=O)NC
CH$IUPAC: InChI=1S/C11H16N2O2/c1-8-7-9(15-11(14)12-2)5-6-10(8)13(3)4/h5-7H,1-4H3,(H,12,14)
CH$LINK: CAS
2032-59-9
CH$LINK: CHEMSPIDER
15416
CH$LINK: INCHIKEY
IMIDOCRTMDIQIJ-UHFFFAOYSA-N
AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40
MS$FOCUSED_ION: PRECURSOR_M/Z 209.1284542215
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
PK$SPLASH: splash10-0079-0900000000-389d8c62467cfceee7ca
PK$NUM_PEAK: 12
PK$PEAK: m/z int. rel.int.
67.054227 1.888293 18
77.038577 4.167385 41
91.054227 1.639002 16
92.062052 1.169117 11
94.065126 5.000232 49
95.049141 1.587092 15
107.049141 1.91438 19
108.056966 2.978256 29
120.056966 4.987445 49
122.06004 100 999
136.07569 38.469779 384
137.083515 72.267113 721
//