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Phma-me-di-pfp

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

Phma-me-di-pfp
SpectraBase Compound ID 46bRH1xcXpY
InChI InChI=1S/C15H8F10O6/c1-30-9(28)11(6-2-4-7(26)5-3-6,8(27)12(16,17)14(20,21)22)31-10(29)13(18,19)15(23,24)25/h2-5,26H,1H3
InChIKey VHXIRVHCLSKKLS-UHFFFAOYSA-N
Mol Weight 474.21 g/mol
Molecular Formula C15H8F10O6
Exact Mass 474.01612 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 5sKlkLrvU0o
Name Phma-me-di-pfp
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 474.016119602 u
Formula C15H8F10O6
InChI InChI=1S/C15H8F10O6/c1-30-9(28)11(6-2-4-7(26)5-3-6,8(27)12(16,17)14(20,21)22)31-10(29)13(18,19)15(23,24)25/h2-5,26H,1H3
InChIKey VHXIRVHCLSKKLS-UHFFFAOYSA-N
Molecular Weight 474.207 g/mol
SMILES C(C(OC(C(C(F)(F)F)(F)F)=O)(C(=O)OC)C1=CC=C(C=C1)O)(C(C(F)(F)F)(F)F)=O
Spectrum/Structure Validation Score (Vapor Phase IR) 0.93621