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2-[[2-(2,4-Difluorophenyl)oxiran-2-yl]-difluoro-methyl]pyridine
SpectraBase Compound ID FwPJt0WvCaS
InChI InChI=1S/C14H9F4NO/c15-9-4-5-10(11(16)7-9)13(8-20-13)14(17,18)12-3-1-2-6-19-12/h1-7H,8H2
InChIKey BCMOKDBAQGMQLW-UHFFFAOYSA-N
Mol Weight 283.23 g/mol
Molecular Formula C14H9F4NO
Exact Mass 283.062027 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID CRqfHJwceYB
Name 2-[[2-(2,4-Difluorophenyl)oxiran-2-yl]-difluoro-methyl]pyridine
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 283.062026565 u
Formula C14H9F4NO
InChI InChI=1S/C14H9F4NO/c15-9-4-5-10(11(16)7-9)13(8-20-13)14(17,18)12-3-1-2-6-19-12/h1-7H,8H2
InChIKey BCMOKDBAQGMQLW-UHFFFAOYSA-N
Molecular Weight 283.226 g/mol
SMILES C1(C(C2=NC=CC=C2)(F)F)(OC1)C=1C(=CC(=CC1)F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.879576