MassBank MassBank Search Contents Download

MassBank Record: MSBNK-EPA-ENTACT_AGILENT000717

(2,2,6,6-Tetramethyl-4-oxopiperidin-1-yl)oxidanyl; ESI-QTOF; MS2; CE: 20; [M+H]+

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

ACCESSION: MSBNK-EPA-ENTACT_AGILENT000717
RECORD_TITLE: (2,2,6,6-Tetramethyl-4-oxopiperidin-1-yl)oxidanyl; ESI-QTOF; MS2; CE: 20; [M+H]+
DATE: 2023.05.02
AUTHORS: EPA CCTE and Agilent Technologies
LICENSE: CC BY

CH$NAME: (2,2,6,6-Tetramethyl-4-oxopiperidin-1-yl)oxidanyl
CH$NAME: DTXSID4044905
CH$COMPOUND_CLASS: N/A
CH$FORMULA: C9H17NO2
CH$EXACT_MASS: 171.1259287943
CH$SMILES: CC1(C)CC(=O)CC(C)(C)N1O
CH$IUPAC: InChI=1S/C9H17NO2/c1-8(2)5-7(11)6-9(3,4)10(8)12/h12H,5-6H2,1-4H3
CH$LINK: CAS 2896-70-0
CH$LINK: INCHIKEY KMEUSKGEUADGET-UHFFFAOYSA-N
CH$LINK: PUBCHEM CID:520789

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 20

MS$FOCUSED_ION: PRECURSOR_M/Z 172.133205246
MS$FOCUSED_ION: PRECURSOR_TYPE [M+H]+
MS$DATA_PROCESSING: WHOLE Agilent ChemVista Version 1.0

PK$SPLASH: splash10-00di-9000000000-bb1bbbb704fd15863e3b
PK$NUM_PEAK: 6
PK$PEAK: m/z int. rel.int.
  55.054227 4.089865 40
  56.049476 7.619179 76
  74.06004 99.999999 999
  74.096426 2.022682 20
  74.109002 1.27119 12
  83.049141 2.942442 29
//

Imprint Feedback
system version 2.2.8

Copyright © 2006 MassBank Project; 2011 NORMAN Association; 2021 MassBank Consortium

Responsible: Tillmann G. Fischer

Funded by the Deutsche Forschungsgemeinschaft (DFG, German Research Foundation) under the National Research Data Infrastructure – NFDI4Chem – Projektnummer 441958208.

de.NBI logo
EAWAG logo
fnr logo
IPB logo
NORMAN logo
UFZ logo
LCSB logo
HBM4EU logo
nfdi4chem logo