MassBank Record: MSBNK-EPA-ENTACT_AGILENT001677
ACCESSION: MSBNK-EPA-ENTACT_AGILENT001677
RECORD_TITLE: N-(Butoxymethyl)acrylamide; ESI-QTOF; MS2; CE: 10; [M-H]-
DATE: 2023.09.19
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY
CH$NAME: N-(Butoxymethyl)acrylamide
CH$NAME: DTXSID9027443
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C8H15NO2
CH$EXACT_MASS: 157.1102787305
CH$SMILES: CCCCOCNC(=O)C=C
CH$IUPAC: InChI=1S/C8H15NO2/c1-3-5-6-11-7-9-8(10)4-2/h4H,2-3,5-7H2,1H3,(H,9,10)
CH$LINK: CAS
1852-16-0
CH$LINK: INCHIKEY
UTSYWKJYFPPRAP-UHFFFAOYSA-N
CH$LINK: PUBCHEM
CID:15817
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 10
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-9000000000-799b8e38a7508ab5992e
PK$NUM_PEAK: 8
PK$PEAK: m/z int. rel.int.
41.998537 36.508126 364
52.019273 6.166439 61
54.034923 3.597686 35
55.018938 1.028401 10
71.050238 100.000003 999
71.095177 1.113925 11
73.065888 47.333428 472
84.045487 7.608751 76
//
system version 2.2.8-SNAPSHOT