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8-ketoazocane-2-carboxylic acid methyl ester

View entire compound with spectra: 1 MS (GC)

8-ketoazocane-2-carboxylic acid methyl ester
SpectraBase Compound ID KP3WfunQ9vm
InChI InChI=1S/C9H15NO3/c1-13-9(12)7-5-3-2-4-6-8(11)10-7/h7H,2-6H2,1H3,(H,10,11)
InChIKey ASHUSPPMCWYLQV-UHFFFAOYSA-N
Mol Weight 185.22 g/mol
Molecular Formula C9H15NO3
Exact Mass 185.105193 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID FYOUum8zYIQ
Name 8-ketoazocane-2-carboxylic acid methyl ester
Alternate Name(s) 8-Oxo-2-azocanecarboxylic acid methyl ester Methyl 8-oxidanylideneazocane-2-carboxylate Methyl 8-oxoazocane-2-carboxylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C9H15NO3
InChI InChI=1S/C9H15NO3/c1-13-9(12)7-5-3-2-4-6-8(11)10-7/h7H,2-6H2,1H3,(H,10,11)
InChIKey ASHUSPPMCWYLQV-UHFFFAOYSA-N
Molecular Weight 185.223 g/mol
SMILES N1C(CCCCCC1C(=O)OC)=O
SPLASH splash10-004i-2900000000-9a59e7a4103e651fc6c2
Source of Spectrum J-64-7840-14
Wiley ID 1531226