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Ethyl 2-cyano-2-(2-oxocycloheptyl)-4-oxobutyrate
SpectraBase Compound ID CooKkKNln2E
InChI InChI=1S/C14H19NO4/c1-2-19-13(18)14(10-15,8-9-16)11-6-4-3-5-7-12(11)17/h9,11H,2-8H2,1H3
InChIKey PYSWUSQYOAWNAY-UHFFFAOYSA-N
Mol Weight 265.31 g/mol
Molecular Formula C14H19NO4
Exact Mass 265.131408 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8zR5dJ2gglB
Name Ethyl 2-cyano-2-(2-oxocycloheptyl)-4-oxobutyrate
Alternate Name(s) Ethyl 2-cyano-4-oxo-2-(2-oxocycloheptyl)butanoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H19NO4
InChI InChI=1S/C14H19NO4/c1-2-19-13(18)14(10-15,8-9-16)11-6-4-3-5-7-12(11)17/h9,11H,2-8H2,1H3
InChIKey PYSWUSQYOAWNAY-UHFFFAOYSA-N
Molecular Weight 265.309 g/mol
SMILES C(C1C(=O)CCCCC1)(C(=O)OCC)(C#N)CC=O
SPLASH splash10-03di-1900000000-8acb7bc25aa0b5e3fe26
Source of Spectrum H1-48-1245-5
Wiley ID 816364