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Butyl (2E)-3-(4-Cyano-3-fluorophenyl)prop-2-enoate
SpectraBase Compound ID LKFFajcbfeF
InChI InChI=1S/C14H14FNO2/c1-2-3-8-18-14(17)7-5-11-4-6-12(10-16)13(15)9-11/h4-7,9H,2-3,8H2,1H3/b7-5+
InChIKey AZFCMIVPQAENJK-FNORWQNLSA-N
Mol Weight 247.27 g/mol
Molecular Formula C14H14FNO2
Exact Mass 247.100857 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 8J6gUmTIfZL
Name Butyl (2E)-3-(4-Cyano-3-fluorophenyl)prop-2-enoate
Alternate Name(s) Butyl (E)-3-(4-cyano-3-fluorophenyl)acrylate
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C14H14FNO2
InChI InChI=1S/C14H14FNO2/c1-2-3-8-18-14(17)7-5-11-4-6-12(10-16)13(15)9-11/h4-7,9H,2-3,8H2,1H3/b7-5+
InChIKey AZFCMIVPQAENJK-FNORWQNLSA-N
Literature Reference DOI 10.1002/hlca.201000412
Molecular Weight 247.269 g/mol
SMILES C(\C=C\c1cc(c(cc1)C#N)F)(=O)OCCCC
SPLASH splash10-006x-0900000000-46984918a44b6c52e3ba
Source of Spectrum H-94-973-8
Wiley ID 1786071