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1-(2-nitrocyclopentyl)butane-2,3-dione
SpectraBase Compound ID 3OVjAgyjxL3
InChI InChI=1S/C9H13NO4/c1-6(11)9(12)5-7-3-2-4-8(7)10(13)14/h7-8H,2-5H2,1H3
InChIKey YWSGSYUIVVCFLT-UHFFFAOYSA-N
Mol Weight 199.21 g/mol
Molecular Formula C9H13NO4
Exact Mass 199.084458 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID BVI1ivTTCsO
Name 1-(2-nitrocyclopentyl)butane-2,3-dione
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13NO4
InChI InChI=1S/C9H13NO4/c1-6(11)9(12)5-7-3-2-4-8(7)10(13)14/h7-8H,2-5H2,1H3
InChIKey YWSGSYUIVVCFLT-UHFFFAOYSA-N
Molecular Weight 199.206 g/mol
SMILES C1(N(=O)=O)C(CC(C(=O)C)=O)CCC1
SPLASH splash10-0006-9100000000-979d879014b8702755b5
Source of Spectrum SO-0-248-6
Wiley ID 873387