MassBank Record: MSBNK-EPA-ENTACT_AGILENT000660
ACCESSION: MSBNK-EPA-ENTACT_AGILENT000660
RECORD_TITLE: Ethyl 3-hydroxybenzoate; ESI-QTOF; MS2; CE: 40; [M-H]-
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY
CH$NAME: Ethyl 3-hydroxybenzoate
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H10O3
CH$EXACT_MASS: 166.0629941859
CH$SMILES: CCOC(=O)C1C=CC=C(O)C=1
CH$IUPAC: InChI=1S/C9H10O3/c1-2-12-9(11)7-4-3-5-8(10)6-7/h3-6,10H,2H2,1H3
CH$LINK: CAS
7781-98-8
CH$LINK: INCHIKEY
MWSMNBYIEBRXAL-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:24522
AC$INSTRUMENT: N/A
AC$INSTRUMENT_TYPE: ESI-QTOF
AC$MASS_SPECTROMETRY: MS_TYPE MS2
AC$MASS_SPECTROMETRY: ION_MODE NEGATIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40
MS$FOCUSED_ION: PRECURSOR_M/Z 165.0557177342
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0
PK$SPLASH: splash10-0006-9000000000-dd6f73f596f078879a85
PK$NUM_PEAK: 10
PK$PEAK: m/z int. rel.int.
39.024024 3.531032 35
41.003288 1.878899 18
43.018938 1.595662 15
65.039674 32.437649 324
67.018938 1.209616 12
75.024024 2.402671 24
92.026763 99.999998 999
92.063149 1.763307 17
93.034588 69.653449 695
93.055718 1.784254 17
//