MassBank Record: MSBNK-EPA-ENTACT_AGILENT001846
ACCESSION: MSBNK-EPA-ENTACT_AGILENT001846
RECORD_TITLE: 2,2'-(3-Chlorophenylimino)diethanol; ESI-QTOF; MS2; CE: 10; [M+H]+
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY
CH$NAME: 2,2'-(3-Chlorophenylimino)diethanol
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C10H14ClNO2
CH$EXACT_MASS: 215.0713064086
CH$SMILES: OCCN(CCO)C1C=CC=C(Cl)C=1
CH$IUPAC: InChI=1S/C10H14ClNO2/c11-9-2-1-3-10(8-9)12(4-6-13)5-7-14/h1-3,8,13-14H,4-7H2
CH$LINK: CAS
92-00-2
CH$LINK: INCHIKEY
MVQUJEUCFOGFJU-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:66688
AC$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$MASS_SPECTROMETRY: COLLISION_ENERGY 10
MS$FOCUSED_ION: PRECURSOR_M/Z 216.0785828603
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0
PK$SPLASH: splash10-014i-0390000000-e2cc42efbcafb74d6ccb
PK$NUM_PEAK: 9
PK$PEAK: m/z int. rel.int.
45.033491 1.373172 13
119.072951 1.823443 18
132.080776 1.236599 12
153.033978 1.734447 17
154.041803 12.153267 121
172.052368 2.791929 27
180.057453 4.091627 40
198.068018 20.094129 200
216.078583 99.999997 999
//