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3C-dfe 2pe

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

3C-dfe 2pe
SpectraBase Compound ID Ff7jiojmy4v
InChI InChI=1S/C23H39F2NO3/c1-6-8-10-12-26(13-11-9-7-2)18(3)14-19-15-20(27-4)23(21(16-19)28-5)29-17-22(24)25/h15-16,18,22H,6-14,17H2,1-5H3
InChIKey MEKKDSLRODDOPR-UHFFFAOYSA-N
Mol Weight 415.6 g/mol
Molecular Formula C23H39F2NO3
Exact Mass 415.2898 g/mol

Vapor Phase (Gas) Infrared Spectrum

Vapor Phase (Gas) Infrared Spectrum

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SpectraBase Spectrum ID 4xsXTDUqWzC
Name 3C-dfe 2pe
Comments Computed using SmartSpectra Model v1.42
Copyright Copyright © 2024-2025 John Wiley & Sons, Inc. All Rights Reserved.
Exact Mass 415.289800443 u
Formula C23H39F2NO3
InChI InChI=1S/C23H39F2NO3/c1-6-8-10-12-26(13-11-9-7-2)18(3)14-19-15-20(27-4)23(21(16-19)28-5)29-17-22(24)25/h15-16,18,22H,6-14,17H2,1-5H3
InChIKey MEKKDSLRODDOPR-UHFFFAOYSA-N
Molecular Weight 415.566 g/mol
SMILES C1(=C(C=C(C=C1OC)CC(N(CCCCC)CCCCC)C)OC)OCC(F)F
Spectrum/Structure Validation Score (Vapor Phase IR) 0.947154