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Cyclooctanone, 2-acetyl-4-nitro-
SpectraBase Compound ID LGAyEna7T1V
InChI InChI=1S/C10H15NO4/c1-7(12)9-6-8(11(14)15)4-2-3-5-10(9)13/h8-9H,2-6H2,1H3
InChIKey CUMAPBJNDRNWPW-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 IKyIPF1K01e
Name Cyclooctanone, 2-acetyl-4-nitro-
CAS Registry Number 86572-39-6
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C10H15NO4
InChI InChI=1S/C10H15NO4/c1-7(12)9-6-8(11(14)15)4-2-3-5-10(9)13/h8-9H,2-6H2,1H3
InChIKey CUMAPBJNDRNWPW-UHFFFAOYSA-N
Molecular Weight 213.233 g/mol
SMILES C1(N(=O)=O)CC(C(=O)CCCC1)C(=O)C
SPLASH splash10-0006-9100000000-374f857015a0ab424c75
Source of Spectrum H-66-853-0
Synonyms 2-Acetyl-4-nitrocyclooctanone
Wiley ID 1212469