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1-(1-oxopentyl)-4,4-diethyl-3,5-pyrazolidinedione
SpectraBase Compound ID 7qRXaSXQXZn
InChI InChI=1S/C12H20N2O3/c1-4-7-8-9(15)14-11(17)12(5-2,6-3)10(16)13-14/h4-8H2,1-3H3,(H,13,16)
InChIKey IZCBCINCULHCQE-UHFFFAOYSA-N
Mol Weight 240.3 g/mol
Molecular Formula C12H20N2O3
Exact Mass 240.147393 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID D3q8YD6xX1A
Name 1-(1-oxopentyl)-4,4-diethyl-3,5-pyrazolidinedione
Alternate Name(s) 4,4-Diethyl-1-pentanoyl-3,5-pyrazolidinedione
CAS Registry Number 126664-31-1
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H20N2O3
InChI InChI=1S/C12H20N2O3/c1-4-7-8-9(15)14-11(17)12(5-2,6-3)10(16)13-14/h4-8H2,1-3H3,(H,13,16)
InChIKey IZCBCINCULHCQE-UHFFFAOYSA-N
Molecular Weight 240.303 g/mol
SMILES N1C(C(C(N1C(=O)CCCC)=O)(CC)CC)=O
SPLASH splash10-052r-9000000000-3d91579abb45c247bcaa
Source of Spectrum J-55-3765-6
Wiley ID 1242750