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2-(6-Chloro-3-pyridinylmethyloxy)-3,3,3-trifluoroprop-1-ene
SpectraBase Compound ID 1exhWuOlLP2
InChI InChI=1S/C9H7ClF3NO/c1-6(9(11,12)13)15-5-7-2-3-8(10)14-4-7/h2-4H,1,5H2
InChIKey PROBCBRKQWNXLQ-UHFFFAOYSA-N
Mol Weight 237.61 g/mol
Molecular Formula C9H7ClF3NO
Exact Mass 237.016826 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 3y4PoWfwLWK
Name 2-(6-Chloro-3-pyridinylmethyloxy)-3,3,3-trifluoroprop-1-ene
Appearance Yellow oil
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 237.016826037 u
Formula C9H7ClF3NO
InChI InChI=1S/C9H7ClF3NO/c1-6(9(11,12)13)15-5-7-2-3-8(10)14-4-7/h2-4H,1,5H2
InChIKey PROBCBRKQWNXLQ-UHFFFAOYSA-N
Instrument Name Waters Ltd TQD
Ionization Type EI Positive ion
Literature Reference DOI 10.1002/ejoc.201901445
Molecular Weight 237.609 g/mol
Quality 75
Reported Formula C9H7NOF3(35)Cl
SMILES C1(Cl)=CC=C(C=N1)COC(=C)C(F)(F)F
SPLASH splash10-000i-0690000000-7e95714d338b5574ab23
Source of Spectrum K1-2019-SM13-3b (DOI: 10.1002/ejoc.201901445)
Wiley ID 1894508