For citations & permissions, please see: Citations & Permissions - Wiley Science Solutions*

*Links on SpectraBase are not permalinks.
Ethyl E-4-[(Z)-1,3,5,6,7-hexahydroazepin-2-ylidene]-5-oxo-2-hexenoate
SpectraBase Compound ID JTq4K48i5o0
InChI InChI=1S/C14H21NO3/c1-3-18-14(17)9-8-12(11(2)16)13-7-5-4-6-10-15-13/h8-9,15H,3-7,10H2,1-2H3/b9-8+,13-12-
InChIKey JWQYWWXNDYXETJ-FRGMPSNRSA-N
Mol Weight 251.33 g/mol
Molecular Formula C14H21NO3
Exact Mass 251.152144 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

View the Full Spectrum for FREE!

The full spectrum can only be viewed using a FREE account.

SpectraBase Spectrum ID 80VwsqABVT1
Name Ethyl E-4-[(Z)-1,3,5,6,7-hexahydroazepin-2-ylidene]-5-oxo-2-hexenoate
Alternate Name(s) Ethyl (2E,4Z)-4-hexahydro-2H-azepin-2-ylidene-5-oxo-2-hexenoate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H21NO3
InChI InChI=1S/C14H21NO3/c1-3-18-14(17)9-8-12(11(2)16)13-7-5-4-6-10-15-13/h8-9,15H,3-7,10H2,1-2H3/b9-8+,13-12-
InChIKey JWQYWWXNDYXETJ-FRGMPSNRSA-N
Molecular Weight 251.326 g/mol
SMILES N1CCCCC\C1=C\(\C=C\C(=O)OCC)C(=O)C
SPLASH splash10-004i-0940000000-f8c4c0d6553fdb60806d
Source of Spectrum F-55-14619-7
Wiley ID 840163