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Cyclododecanecarboxylic acid, 5-nitro-2,12-dioxo-, methyl ester
SpectraBase Compound ID 8sWjF5sLVwk
InChI InChI=1S/C14H21NO6/c1-21-14(18)13-11(16)7-5-3-2-4-6-10(15(19)20)8-9-12(13)17/h10,13H,2-9H2,1H3
InChIKey HNMJMPAVCREJRM-UHFFFAOYSA-N
Mol Weight 299.32 g/mol
Molecular Formula C14H21NO6
Exact Mass 299.136887 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID JNHk8hw7MVA
Name Cyclododecanecarboxylic acid, 5-nitro-2,12-dioxo-, methyl ester
Alternate Name(s) Methyl 5-nitro-2,12-dioxo-cyclododecane-1-carboxylate Methyl 5-nitro-2,12-dioxocyclododecanecarboxylate
CAS Registry Number 86572-43-2
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21NO6
InChI InChI=1S/C14H21NO6/c1-21-14(18)13-11(16)7-5-3-2-4-6-10(15(19)20)8-9-12(13)17/h10,13H,2-9H2,1H3
InChIKey HNMJMPAVCREJRM-UHFFFAOYSA-N
Molecular Weight 299.323 g/mol
SMILES C1(N(=O)=O)CCC(C(C(=O)OC)C(=O)CCCCCC1)=O
SPLASH splash10-05mo-9300000000-4163047cbb1b4cb77fe9
Source of Spectrum H-66-856-0
Wiley ID 1301781