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2-methyl-2-nitrocyclohexan-1-one
SpectraBase Compound ID 8qv4ACREsTC
InChI InChI=1S/C7H11NO3/c1-7(8(10)11)5-3-2-4-6(7)9/h2-5H2,1H3
InChIKey QUWXLKXLGLRHDT-UHFFFAOYSA-N
Mol Weight 157.17 g/mol
Molecular Formula C7H11NO3
Exact Mass 157.073893 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID HBqDtHPCZNz
Name Cyclohexanone, 2-methyl-2-nitro-
Alternate Name(s) 2-Methyl-2-nitro-1-cyclohexanone 2-Methyl-2-nitro-cyclohexan-1-one 2-Methyl-2-nitro-cyclohexanone
CAS Registry Number 80594-87-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C7H11NO3
InChI InChI=1S/C7H11NO3/c1-7(8(10)11)5-3-2-4-6(7)9/h2-5H2,1H3
InChIKey QUWXLKXLGLRHDT-UHFFFAOYSA-N
Molecular Weight 157.169 g/mol
SMILES C1(N(=O)=O)(C(=O)CCCC1)C
SPLASH splash10-0api-9000000000-0d9f8040d73ce22b89a0
Source of Spectrum O-21-767-3
Wiley ID 1154585