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2-(4-Nitrobutanoyl)cyclopentanone
SpectraBase Compound ID USDSuiOyBc
InChI InChI=1S/C9H13NO4/c11-8-4-1-3-7(8)9(12)5-2-6-10(13)14/h7H,1-6H2
InChIKey ZOHLGRPOWUCMGN-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 1Si09w4wkQB
Name 2-(4-Nitrobutanoyl)cyclopentanone
Alternate Name(s) 2-(4-nitro-1-oxobutyl)-1-cyclopentanone 2-(4-nitrobutanoyl)cyclopentan-1-one
CAS Registry Number 79630-91-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H13NO4
InChI InChI=1S/C9H13NO4/c11-8-4-1-3-7(8)9(12)5-2-6-10(13)14/h7H,1-6H2
InChIKey ZOHLGRPOWUCMGN-UHFFFAOYSA-N
Molecular Weight 199.206 g/mol
SMILES C1(=O)C(CCC1)C(=O)CCCN(=O)=O
SPLASH splash10-08gi-9500000000-30e204e16e4296e832a9
Wiley ID 1480618