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6,7-bis(Pentafluoropropionyloxy)coumarin

View entire compound with spectra: 1 FTIR

6,7-bis(Pentafluoropropionyloxy)coumarin
SpectraBase Compound ID FZs2fH9NoLt
InChI InChI=1S/C15H4F10O6/c16-12(17,14(20,21)22)10(27)30-7-3-5-1-2-9(26)29-6(5)4-8(7)31-11(28)13(18,19)15(23,24)25/h1-4H
InChIKey NSIWSRGEEIQNRQ-UHFFFAOYSA-N
Mol Weight 470.18 g/mol
Molecular Formula C15H4F10O6
Exact Mass 469.984819 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID GGmAeK3x07l
Name 6,7-bis(Pentafluoropropionyloxy)coumarin
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 469.984819473 u
Formula C15H4F10O6
InChI InChI=1S/C15H4F10O6/c16-12(17,14(20,21)22)10(27)30-7-3-5-1-2-9(26)29-6(5)4-8(7)31-11(28)13(18,19)15(23,24)25/h1-4H
InChIKey NSIWSRGEEIQNRQ-UHFFFAOYSA-N
Molecular Weight 470.175 g/mol
SMILES C1(=C(OC(C(C(F)(F)F)(F)F)=O)C=C2C(=C1)OC(=O)C=C2)OC(C(C(F)(F)F)(F)F)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.927452