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3-Pyrazolidinone, 4-methyl-1-[(2-nitrophenyl)methyl]-, (.+-.)-
SpectraBase Compound ID JBOkqYDKqnB
InChI InChI=1S/C11H13N3O3/c1-8-6-13(12-11(8)15)7-9-4-2-3-5-10(9)14(16)17/h2-5,8H,6-7H2,1H3,(H,12,15)
InChIKey HAPUORJMNYCUAN-UHFFFAOYSA-N
Mol Weight 235.24 g/mol
Molecular Formula C11H13N3O3
Exact Mass 235.095691 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 9X0OLkEpFIC
Name 3-Pyrazolidinone, 4-methyl-1-[(2-nitrophenyl)methyl]-, (.+-.)-
CAS Registry Number 130064-91-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C11H13N3O3
InChI InChI=1S/C11H13N3O3/c1-8-6-13(12-11(8)15)7-9-4-2-3-5-10(9)14(16)17/h2-5,8H,6-7H2,1H3,(H,12,15)
InChIKey HAPUORJMNYCUAN-UHFFFAOYSA-N
Molecular Weight 235.243 g/mol
SMILES N1C(C(CN1Cc1c(N(=O)=O)cccc1)C)=O
SPLASH splash10-00dj-7950000000-23352aaead47758cfc3a
Source of Spectrum J-55-6043-22
Synonyms 4-Methyl-1-(2-nitrobenzyl)-3-pyrazolidinone 4-Methyl-1-(o-nitrobenzyl)pyrazolidin-3-one
Wiley ID 1236933