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4-(Trifluoromethyl)-6H-dibenzo[b,d]pyran

View entire compound with spectra: 1 FTIR, and 1 MS (GC)

4-(Trifluoromethyl)-6H-dibenzo[b,d]pyran
SpectraBase Compound ID 2WVX1Jd27xt
InChI InChI=1S/C14H9F3O/c15-14(16,17)12-7-3-6-11-10-5-2-1-4-9(10)8-18-13(11)12/h1-7H,8H2
InChIKey OZMSJQWMGDIAIV-UHFFFAOYSA-N
Mol Weight 250.22 g/mol
Molecular Formula C14H9F3O
Exact Mass 250.060549 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 7Kh7SV9c8e0
Name 4-(Trifluoromethyl)-6H-dibenzo[B,D]pyran
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 250.060549398 u
Formula C14H9F3O
InChI InChI=1S/C14H9F3O/c15-14(16,17)12-7-3-6-11-10-5-2-1-4-9(10)8-18-13(11)12/h1-7H,8H2
InChIKey OZMSJQWMGDIAIV-UHFFFAOYSA-N
Molecular Weight 250.220 g/mol
SMILES C=1C=CC=2C=3C=CC=CC3COC2C1C(F)(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.836556