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

*Links on SpectraBase are not permalinks.
Ethyl (Z)-N-(4-cyano-1-((E)-3,3,3-trifluoroprop-1-en-1-yl)-1H-pyrazol-5-yl)acetimidate
SpectraBase Compound ID Cg6zyRN17R
InChI InChI=1S/C11H11F3N4O/c1-3-19-8(2)17-10-9(6-15)7-16-18(10)5-4-11(12,13)14/h4-5,7H,3H2,1-2H3/b5-4+,17-8-
InChIKey UMCHDGHKAYFSFA-ZPCHUTRJSA-N
Mol Weight 272.23 g/mol
Molecular Formula C11H11F3N4O
Exact Mass 272.088495 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 xfYntLqihK
Name Ethyl (Z)-N-(4-cyano-1-((E)-3,3,3-trifluoroprop-1-en-1-yl)-1H-pyrazol-5-yl)acetimidate
Appearance White solid
Carrier Gas Helium
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 272.088495478 u
Formula C11H11F3N4O
GC Column HP-5MS (30 m x 0.25 mm, film thickness 0.25 micrometer)
InChI InChI=1S/C11H11F3N4O/c1-3-19-8(2)17-10-9(6-15)7-16-18(10)5-4-11(12,13)14/h4-5,7H,3H2,1-2H3/b5-4+,17-8-
InChIKey UMCHDGHKAYFSFA-ZPCHUTRJSA-N
Instrument Name Agilent 6890N-Agilent 5973
Ionization Type EI positive ion
Literature Reference DOI 10.1002/chem.202102840
Molecular Weight 272.231 g/mol
Quality 175
Reported Formula C11H11N4OF3
SMILES C(C)O\C(C)=N\C1=C(C=NN1\C=C\C(F)(F)F)C#N
SPLASH splash10-004i-1980000000-0d8d7bccbee31606ed69
Source of Spectrum QE-27-SM32-22 (DOI: 10.1002/chem.202102840)
Thin-Layer Chromatography 0.72 (hexanes/EtOAc, 3:1)
Wiley ID 1904227