MassBank Record: MSBNK-EPA-ENTACT_AGILENT001678
ACCESSION: MSBNK-EPA-ENTACT_AGILENT001678
RECORD_TITLE: N-(Butoxymethyl)acrylamide; ESI-QTOF; MS2; CE: 40; [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 POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION ESI
AC$MASS_SPECTROMETRY: COLLISION_ENERGY 40
MS$FOCUSED_ION: PRECURSOR_M/Z 158.1175551822
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0
PK$SPLASH: splash10-03di-9000000000-d3ff585095f90d268329
PK$NUM_PEAK: 14
PK$PEAK: m/z int. rel.int.
45.992355 3.714646 37
47.00018 25.28053 252
47.999451 10.34274 103
55.017841 1.992118 19
61.007276 9.391846 93
62.015101 9.125695 91
63.022927 4.961235 49
63.994366 99.999999 999
64.030752 2.179929 21
64.039305 1.528774 15
65.002191 34.912386 348
65.99744 2.861955 28
79.017841 20.422371 204
80.025666 16.883338 168
//
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