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6-Nitro-9-oxodecanoic acid ethyl ester
SpectraBase Compound ID 9XpYeTufhex
InChI InChI=1S/C12H21NO5/c1-3-18-12(15)7-5-4-6-11(13(16)17)9-8-10(2)14/h11H,3-9H2,1-2H3
InChIKey RXWMLRVDAIBVDJ-UHFFFAOYSA-N
Mol Weight 259.3 g/mol
Molecular Formula C12H21NO5
Exact Mass 259.141973 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID R9pp8q9hDc
Name 6-Nitro-9-oxodecanoic acid ethyl ester
Alternate Name(s) 9-keto-6-nitro-capric acid ethyl ester Ethyl 6-nitro-9-oxidanylidene-decanoate Ethyl 6-nitro-9-oxo-decanoate
CAS Registry Number 87298-06-4
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H21NO5
InChI InChI=1S/C12H21NO5/c1-3-18-12(15)7-5-4-6-11(13(16)17)9-8-10(2)14/h11H,3-9H2,1-2H3
InChIKey RXWMLRVDAIBVDJ-UHFFFAOYSA-N
Molecular Weight 259.302 g/mol
SMILES C(N(=O)=O)(CCC(=O)C)CCCCC(=O)OCC
SPLASH splash10-0006-9100000000-bee4cc621a6b3d52e82f
Source of Spectrum H-66-1523-0
Wiley ID 1262584