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MassBank Record: JP010502

N-3-ACETOXY-2,2-DIMETHYLPROPIONYL-N-BUTYL-2,3-DIMETHYLPENT-4-ENAMIDE; EI-B; MS

Mass Spectrum
Chemical Structure
Generated by the Chemistry Development Kit (http://github.com/cdk)

ACCESSION: JP010502
RECORD_TITLE: N-3-ACETOXY-2,2-DIMETHYLPROPIONYL-N-BUTYL-2,3-DIMETHYLPENT-4-ENAMIDE; EI-B; MS
DATE: 2016.01.19 (Created 2008.10.21, modified 2011.05.06)
AUTHORS: TSUNODA T, FACULTY OF PHARMACEUTICAL SCIENCES, TOKUSHIMA BUNRI UNIV.
LICENSE: CC BY-NC-SA

CH$NAME: N-3-ACETOXY-2,2-DIMETHYLPROPIONYL-N-BUTYL-2,3-DIMETHYLPENT-4-ENAMIDE
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C18H31NO4
CH$EXACT_MASS: 325.22531
CH$SMILES: CCCCN(C(=O)C(C)C(C)C=C)C(=O)C(C)(C)COC(C)=O
CH$IUPAC: InChI=1S/C18H31NO4/c1-8-10-11-19(16(21)14(4)13(3)9-2)17(22)18(6,7)12-23-15(5)20/h9,13-14H,2,8,10-12H2,1,3-7H3
CH$LINK: INCHIKEY QYDLGJPYMBVRDX-UHFFFAOYSA-N

AC$INSTRUMENT: SHIMADZU LKB-9000B
AC$INSTRUMENT_TYPE: EI-B
AC$MASS_SPECTROMETRY: MS_TYPE MS
AC$MASS_SPECTROMETRY: ION_MODE POSITIVE
AC$MASS_SPECTROMETRY: IONIZATION_ENERGY 70 eV

MS$FOCUSED_ION: ION_TYPE [M]+*

PK$SPLASH: splash10-0536-9300000000-260f6d34276540dcda8f
PK$NUM_PEAK: 36
PK$PEAK: m/z int. rel.int.
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  168 35 350
  183 7.2 72
  184 27.8 278
  326 1 10
//

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