MassBank Record: MSBNK-EPA-ENTACT_AGILENT001551
ACCESSION: MSBNK-EPA-ENTACT_AGILENT001551
RECORD_TITLE: 4-Methoxybenzenamine; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY
CH$NAME: 4-Methoxybenzenamine
CH$NAME: DTXSID3020093
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C7H9NO
CH$EXACT_MASS: 123.0684139168
CH$SMILES: COC1C=CC(N)=CC=1
CH$IUPAC: InChI=1S/C7H9NO/c1-9-7-4-2-6(8)3-5-7/h2-5H,8H2,1H3
CH$LINK: CAS
104-94-9
CH$LINK: INCHIKEY
BHAAPTBBJKJZER-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:7732
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 20
MS$FOCUSED_ION: PRECURSOR_M/Z 124.0756903685
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0
PK$SPLASH: splash10-0006-9200000000-a34de6b8bc80b4140441
PK$NUM_PEAK: 19
PK$PEAK: m/z int. rel.int.
39.022927 1.107477 11
46.065126 1.14882 11
51.022927 2.981959 29
63.022927 2.032082 20
64.030752 7.416268 74
65.038577 9.445886 94
66.046402 3.372515 33
77.038577 29.279318 292
79.054227 2.652279 26
80.049476 9.987114 99
81.057301 23.618185 235
92.025666 26.453377 264
92.049476 26.304169 262
93.057301 99.999999 999
107.049141 2.595733 25
108.04439 6.739805 67
109.052215 26.606618 265
123.067865 4.028025 40
124.07569 19.46594 194
//