MassBank Record: MSBNK-EPA-ENTACT_AGILENT001249
ACCESSION: MSBNK-EPA-ENTACT_AGILENT001249
RECORD_TITLE: N-(Isobutoxymethyl)acrylamide; ESI-QTOF; MS2; CE: 20; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY
CH$NAME: N-(Isobutoxymethyl)acrylamide
CH$NAME: DTXSID2044848
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H15NO2
CH$EXACT_MASS: 157.1102787305
CH$SMILES: CC(C)COCNC(=O)C=C
CH$IUPAC: InChI=1S/C8H15NO2/c1-4-8(10)9-6-11-5-7(2)3/h4,7H,1,5-6H2,2-3H3,(H,9,10)
CH$LINK: CAS
16669-59-3
CH$LINK: INCHIKEY
KCTMTGOHHMRJHZ-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:27979
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$FOCUSED_ION: PRECURSOR_M/Z 156.1030022788
MS$FOCUSED_ION: PRECURSOR_TYPE [M-H]-
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0
PK$SPLASH: splash10-00di-9000000000-55a7b8ed317eda3b1019
PK$NUM_PEAK: 6
PK$PEAK: m/z int. rel.int.
41.998537 17.343598 173
52.019273 1.823966 18
71.050238 99.999996 999
71.086624 1.395466 13
73.065888 21.342145 213
84.045487 1.149598 11
//
system version 2.2.8-SNAPSHOT