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2-(4-Nitrobutanoyl)cyclohexanone
SpectraBase Compound ID HbaZNEDunyP
InChI InChI=1S/C10H15NO4/c12-9-5-2-1-4-8(9)10(13)6-3-7-11(14)15/h8H,1-7H2
InChIKey PJSQIKXMVYMSJO-UHFFFAOYSA-N
Mol Weight 213.23 g/mol
Molecular Formula C10H15NO4
Exact Mass 213.100108 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID CbxyHVbIvMR
Name 2-(4-Nitrobutanoyl)cyclohexanone
CAS Registry Number 79630-88-9
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO4
InChI InChI=1S/C10H15NO4/c12-9-5-2-1-4-8(9)10(13)6-3-7-11(14)15/h8H,1-7H2
InChIKey PJSQIKXMVYMSJO-UHFFFAOYSA-N
Molecular Weight 213.233 g/mol
SMILES C1CCCC(C1=O)C(=O)CCCN(=O)=O
SPLASH splash10-004i-9600000000-33b12d1f4859cdb8e4b7
Synonyms 1-Butanone, 4-nitro-1-(2-oxocyclohexyl)- 2-(4-nitro-1-oxobutyl)-1-cyclohexanone 2-(4-nitrobutanoyl)cyclohexan-1-one
Wiley ID 1478167