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

*Links on SpectraBase are not permalinks.
Ethyl (E)-2-ethoxycarbonyl-3-tert-butyl-6,6,6-trifluoro-4-hexenoate
SpectraBase Compound ID Bzv8Czvcoq2
InChI InChI=1S/C15H23F3O4/c1-6-21-12(19)11(13(20)22-7-2)10(14(3,4)5)8-9-15(16,17)18/h8-11H,6-7H2,1-5H3/b9-8+
InChIKey RJWNUWUJFQNXFS-CMDGGOBGSA-N
Mol Weight 324.34 g/mol
Molecular Formula C15H23F3O4
Exact Mass 324.154844 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 7zN9P7MexMy
Name Ethyl (E)-2-ethoxycarbonyl-3-tert-butyl-6,6,6-trifluoro-4-hexenoate
Alternate Name(s) Diethyl 2-[(2E)-1-tert-butyl-4,4,4-trifluoro-2-butenyl]malonate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C15H23F3O4
InChI InChI=1S/C15H23F3O4/c1-6-21-12(19)11(13(20)22-7-2)10(14(3,4)5)8-9-15(16,17)18/h8-11H,6-7H2,1-5H3/b9-8+
InChIKey RJWNUWUJFQNXFS-CMDGGOBGSA-N
Molecular Weight 324.340 g/mol
SMILES C(C(C(\C=C\C(F)(F)F)C(C)(C)C)C(=O)OCC)(=O)OCC
SPLASH splash10-0aor-9550000000-052a801f2af25c7610f1
Source of Spectrum AU-676-48-5
Wiley ID 1575716