ACCESSION: MSBNK-EPA-ENTACT_AGILENT002494
RECORD_TITLE: Ethyl tetradecanoate; ESI-QTOF; MS2; CE: 20; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: Ethyl tetradecanoate
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C₁₆H₃₂O₂
CH$EXACT_MASS: 256.2402302654
CH$SMILES: CCCCCCCCCCCCCC(=O)OCC
CH$IUPAC: InChI=1S/C16H32O2/c1-3-5-6-7-8-9-10-11-12-13-14-15-16(17)18-4-2/h3-15H2,1-2H3
CH$LINK: CAS 124-06-1
CH$LINK: INCHIKEY MMKRHZKQPFCLLS-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:31283

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 20

MS$FOCUSED_ION: PRECURSOR_M/Z 255.2329538137
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-0a4i-0090000000-1b4b4fb9da7aeb375f72
PK$NUM_PEAK: 2
PK$PEAK: m/z int. rel.int.
237.222389 1.051418 10
255.232954 100 999
//