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1-(4-Methylbenzyl)-5-methylpyrrolidin-2-one
SpectraBase Compound ID IIJpaYqSZxB
InChI InChI=1S/C13H17NO/c1-10-3-6-12(7-4-10)9-14-11(2)5-8-13(14)15/h3-4,6-7,11H,5,8-9H2,1-2H3
InChIKey BAYRDFDHJCWXEO-UHFFFAOYSA-N
Mol Weight 203.28 g/mol
Molecular Formula C13H17NO
Exact Mass 203.131014 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BOwE2LhoCxw
Name 1-(4-Methylbenzyl)-5-methylpyrrolidin-2-one
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 203.131014170 u
Formula C13H17NO
InChI InChI=1S/C13H17NO/c1-10-3-6-12(7-4-10)9-14-11(2)5-8-13(14)15/h3-4,6-7,11H,5,8-9H2,1-2H3
InChIKey BAYRDFDHJCWXEO-UHFFFAOYSA-N
Instrument Name LRMS
Ionization Type EI
Literature Reference DOI 10.1002/anie.201509465
Molecular Weight 203.285 g/mol
SMILES C(N1C(CCC1C)=O)C1=CC=C(C=C1)C
SPLASH splash10-0a4j-2920000000-af0051cf38f14dd73f54
Source of Spectrum ACI-55-SM11-3w (DOI: 10.1002/anie.201509465)
Wiley ID 1895269